Rigosertib

Rigosertib

SCHEMBL29360545

COc1cc(OC)c(/C=C/S(=O)(=O)Cc2ccc(OC)c(NCC(=O)[O-])c2)c(OC)c1.[Na+]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Rigosertib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 4/20 1.00
MET P08581 1/20 0.81
NQO2 P16083 1/20 0.81
FECH P22830 1/20 0.81
CLK3 P49761 1/20 0.81
HDAC8 Q9BY41 3/20 0.78
HDAC3 O15379 2/20 0.78
HDAC4 P56524 2/20 0.78
HDAC1 Q13547 2/20 0.78
HDAC7 Q8WUI4 2/20 0.78
HDAC2 Q92769 2/20 0.78
HDAC10 Q969S8 2/20 0.78
HDAC11 Q96DB2 2/20 0.78
HDAC6 Q9UBN7 2/20 0.78
HDAC9 Q9UKV0 2/20 0.78
HDAC5 Q9UQL6 2/20 0.78
ABCG2 Q9UNQ0 1/20 0.39
ALDH1A1 P00352 4/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Rigosertib SCHEMBL4726480 1.00 PLK1 (1.00) PLK1METNQO2FECHCLK3
Rigosertib SCHEMBL498729 1.00 PLK1 (1.00) PLK1METNQO2FECHCLK3
Rigosertib SCHEMBL29397572 0.90 PLK1 (1.00) PLK1METNQO2FECHCLK3
Rigosertib SCHEMBL498623 0.90 PLK1 (1.00) PLK1METNQO2FECHCLK3
SCHEMBL498448 0.90 PLK1 (0.84) PLK1METNQO2FECHCLK3
SCHEMBL498447 0.90 PLK1 (0.84) PLK1METNQO2FECHCLK3
Rigosertib SCHEMBL498624 0.90 PLK1 (1.00) PLK1METNQO2FECHCLK3
Rigosertib SCHEMBL498728 0.89 PLK1 (0.98) PLK1METNQO2FECHCLK3
Rigosertib SCHEMBL498730 0.89 PLK1 (0.98) PLK1METNQO2FECHCLK3
SCHEMBL15835693 0.85 PLK1 (0.77) PLK1METNQO2FECHCLK3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022144780-A1 SULFONAMIDE DERIVATIVES, COMPOSITIONS COMPRISING SAME AND USES THEREOF IN THE TREATMENT OF CANCERS NATIONAL CANCER CENTER (JP) 2022-07-07 WO claimed
CN-122029161-A Crystalline forms of PI3K inhibitors and uses thereof 蝎子疗法股份有限公司 2026-05-12 CN disclosed
US-12605387-B2 Treatment of cancers using PI3 kinase isoform modulators SECURA BIO, INC. (US) 2026-04-21 US disclosed
EP-3868384-B1 CYCLIC DINUCLEOTIDES AS STING (STIMULATOR OF INTERFERON GENES) AGONISTS TAKEDA PHARMACEUTICALS CO (JP) 2026-02-25 EP disclosed
US-12545896-B2 Growth inhibitor Orizuru Therapeutics, Inc. (JP) 2026-02-10 US disclosed
US-20250319091-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS INFINITY PHARMACEUTICALS INC (US) 2025-10-16 US disclosed
US-12435063-B2 Nitrogen containing heterocycles as CDK12 inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-10-07 US disclosed
EP-4611748-A1 COMBINATION THERAPY FOR TREATING CANCER Scorpion Therapeutics, Inc. (US) 2025-09-10 EP disclosed
US-20250262298-A1 STING MODULATOR COMPOUNDS WITH SULFAMATE LINKAGES, AND METHODS OF MAKING AND USING TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2025-08-21 US disclosed
EP-4396189-B1 IRON-ACTIVABLE NITROGEN-CONTAINING DERIVATIVES OF SALINOMYCIN AND NARASIN, SYNTHESIS AND USE FOR THE TREATMENT OF CANCERS CENTRE NAT RECH SCIENT (FR) 2025-08-13 EP disclosed
CN-114729004-A Heterocyclic compounds 日商泛美克斯股份有限公司 2022-07-08 CN disclosed
WO-2022144780-A1 SULFONAMIDE DERIVATIVES, COMPOSITIONS COMPRISING SAME AND USES THEREOF IN THE TREATMENT OF CANCERS NATIONAL CANCER CENTER (JP) 2022-07-07 WO disclosed
CN-109790122-B Heterocyclic compounds 武田药品工业株式会社 2022-06-24 CN disclosed
US-11351209-B2 Inhibitors of PI3K p-delta 110 for use in delivery of viruses in the treatment of cancer QUEEN MARY UNIVERSITY OF LONDON (GB) 2022-06-07 US disclosed
EP-4006037-A1 HETEROCYCLIC COMPOUND Fimecs, Inc. (JP) 2022-06-01 EP disclosed
EP-3514149-B1 HETEROCYCLIC AMIDE COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2022-05-18 EP disclosed
CN-114423767-A Artemisinin derivative N-heterocyclic carbene gold (I) hybrid compound 法国国家科学研究中心 2022-04-29 CN disclosed
US-20220089595-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2022-03-24 US disclosed
EP-3241846-B1 B7 FAMILY MEMBER ZB7H6 AND RELATED COMPOSITIONS AND METHODS ZYMOGENETICS INC (US) 2022-02-23 EP disclosed
WO-2022019920-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS VERASTEM, INC. (US) 2022-01-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220089595-A1 HETEROCYCLIC COMPOUND MALT1, SQSTM1, PPM1D PLK1 4739/4885MET 1995/4885NQO2 2237/4885
US-11351209-B2 Inhibitors of PI3K p-delta 110 for use in delivery of viruses in the treatment of cancer PI4KA, PIK3CA, PIK3R4 PLK1 75/4885MET 1596/4885NQO2 3867/4885
US-20250262298-A1 STING MODULATOR COMPOUNDS WITH SULFAMATE LINKAGES, AND METHODS OF MAKING AND USING STING1, CGAS, TBK1 PLK1 238/4885MET 4562/4885NQO2 925/4885
US-12605387-B2 Treatment of cancers using PI3 kinase isoform modulators PIK3R5, PIK3R4, PIK3CD PLK1 283/4885MET 1508/4885NQO2 2708/4885
US-12435063-B2 Nitrogen containing heterocycles as CDK12 inhibitors CDK1, CDK12, CDK15 PLK1 26/4885MET 2912/4885NQO2 679/4885
US-20250319091-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS PIK3CA, MCL1, PIK3CB PLK1 49/4885MET 755/4885NQO2 1737/4885
US-12545896-B2 Growth inhibitor IAPP, PLK4, IGF1R PLK1 62/4885MET 167/4885NQO2 1916/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.