SCHEMBL29378693

SCHEMBL29378693

Cc1ccc(Nc2cc(Br)c(N)c3c2C(=O)c2ccccc2C3=O)c(S(=O)(=O)[O-])c1.[Na+]

nearest known ligand 0.70

Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of None. 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
P2RY4 known ✓ P51582 11/20 0.70
P2RY2 known ✓ P41231 8/20 0.70
P2RY12 known ✓ Q9H244 6/20 0.64
P2RY6 known ✓ Q15077 1/20 0.61
THRB known ✓ P10828 1/20 0.59
P2RY1 known ✓ P47900 1/20 0.59
MET P08581 2/20 0.61
MEN1 O00255 1/20 0.59
NSD2 O96028 1/20 0.59
ALDH1A1 P00352 1/20 0.59
POLB P06746 1/20 0.59
MAPT P10636 1/20 0.59
HPGD P15428 1/20 0.59
MAPK1 P28482 1/20 0.59
RECQL P46063 1/20 0.59
KMT2A Q03164 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
NPSR1 Q6W5P4 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL29625851 0.90 P2RY4 (0.85) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL29776286 0.89 P2RY4 (0.76) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL11157198 0.88 P2RY4 (0.56) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL28415421 0.87 P2RY4 (0.55) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL29350751 0.86 P2RY4 (0.67) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL126076 0.86 P2RY4 (0.67) P2RY4P2RY2P2RY12METP2RY6
Hydrochloric Acid SCHEMBL30808003 0.85 P2RY4 (0.65) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL13346004 0.84 P2RY4 (0.68) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL29637834 0.82 P2RY4 (0.61) P2RY4P2RY2P2RY12METP2RY6
SCHEMBL30106754 0.82 P2RY4 (0.61) P2RY4P2RY2P2RY12METP2RY6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025149345-A1 LAUNDRY DETERGENT PRODUCT UNILEVER IP HOLDINGS B.V. (NL) 2025-07-17 WO claimed
US-12152343-B1 Trichromatic fiber dyeing processes and compositions thereof COLUMBIA INSURANCE COMPANY (US) 2024-11-26 US claimed
CN-114981395-B Laundry detergent product 联合利华知识产权控股有限公司 2024-11-26 CN claimed
US-20230407208-A1 LAUNDRY DETERGENT PRODUCT CONOPCO, INC., D/B/A UNILEVER (US) 2023-12-21 US claimed
EP-4097206-B1 LAUNDRY DETERGENT PRODUCT UNILEVER IP HOLDINGS B V (NL) 2023-08-09 EP claimed
EP-4097206-A1 LAUNDRY DETERGENT PRODUCT Unilever IP Holdings B.V. (NL) 2022-12-07 EP claimed
CN-115066484-A Laundry detergent product 联合利华知识产权控股有限公司 2022-09-16 CN claimed
CN-114981395-A Laundry detergent product 联合利华知识产权控股有限公司 2022-08-30 CN claimed
EP-4547208-B1 PROCESS FOR REMOVING THE COLOUR FROM PREVIOUSLY DYED KERATINOUS HAIR FIBRES OREAL (FR) 2026-05-27 EP disclosed
US-12636246-B2 Process for colouring hair keratin fibers, comprising the application of a composition comprising at least one (poly)carbodiimide compound and a composition comprising at least one associative polymer and a particular compound L'OREAL (FR) 2026-05-26 US disclosed
CN-122094656-A Method for dyeing hair keratin fibres, comprising the step of washing the hair keratin fibres with a particular composition and subsequently applying to the hair keratin fibres a particular dyeing composition 2026-05-26 CN disclosed
US-20260115118-A1 COSMETIC COMPOSITIONS COMPRISING DRAGLINE SPIDER SILK SEEVIX MATERIAL SCIENCES LTD. (IL) 2026-04-30 US disclosed
EP-4362892-B1 COMPOSITION COMPRISING AT LEAST ONE ALKYL (POLY)GLYCOSIDE, AT LEAST ONE FATTY ALCOHOL, AT LEAST ONE FATTY ACID, AND AT LEAST ONE ALKALINE AGENT OREAL (FR) 2026-04-15 EP disclosed
WO-2026039882-A1 METHODS FOR REDUCING COLOR FADING IN COLOR-TREATED HAIR L'OREAL (FR) 2026-02-26 WO disclosed
CN-107918246-B Colored curable resin composition 住友化学株式会社 2022-02-25 CN disclosed
CN-108885394-B Imprint resist and substrate pretreatment for reducing fill time for nanoimprint lithography 佳能株式会社 2022-02-25 CN disclosed
CN-114080567-A Composition containing colorant 住友化学株式会社 2022-02-22 CN disclosed
CN-107797382-B Coloring composition 住友化学株式会社 2022-02-22 CN disclosed
CN-107797381-B Coloring composition and compound 住友化学株式会社 2022-02-18 CN disclosed
CN-106892891-B Compound, colored curable resin composition, color filter, and liquid crystal display device 东友精细化工有限公司 2022-02-11 CN 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 (2 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-20260115118-A1 COSMETIC COMPOSITIONS COMPRISING DRAGLINE SPIDER SILK CUTA, MC1R, SPPL2B P2RY4 2562/4885P2RY2 1384/4885P2RY12 1057/4885
US-12636246-B2 Process for colouring hair keratin fibers, comprising the application of a composition comprising at least one (poly)carbodiimide compound and a composition comprising at least one associative polymer and a particular compound KRT18, CYC1, CYBA P2RY4 4709/4885P2RY2 4718/4885P2RY12 4498/4885

“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.