SCHEMBL30661045

SCHEMBL30661045

O=C(Nc1ccc2c(O)c(N=Nc3ccccc3)c(S(=O)(=O)O)cc2c1)Nc1ccc2c(O)c(N=Nc3ccc4cc(S(=O)(=O)O)ccc4c3)c(S(=O)(=O)O)cc2c1.[H-].[Na+]

nearest known ligand 0.96

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 19)

geneUniProtsupporting neighboursconfidence
▸ CA2 known ✓ P00918 1/20 0.48
▸ THRB known ✓ P10828 1/20 0.45
▸ ENPP2 Q13822 10/20 0.96
▸ PRMT1 Q99873 3/20 0.73
▸ PRMT3 O60678 1/20 0.73
▸ EP300 Q09472 1/20 0.73
▸ PRMT6 Q96LA8 1/20 0.73
▸ CD40 P25942 1/20 0.72
▸ CD40LG P29965 1/20 0.72
▸ CA3 P07451 1/20 0.48
▸ PHLPP2 Q6ZVD8 1/20 0.47
▸ CYP1A2 P05177 2/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.45
▸ HIF1A Q16665 1/20 0.45
▸ CARM1 Q86X55 1/20 0.45

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
SCHEMBL29538633 0.91 ENPP2 (0.86) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL29926756 0.87 ENPP2 (0.79) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL30371624 0.86 PRMT1 (0.98) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL10623011 0.86 PRMT1 (0.98) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL20621514 0.85 PRMT1 (0.80) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL29363217 0.85 ENPP2 (0.73) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL23259402 0.85 PRMT1 (1.00) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL29637780 0.85 PRMT1 (1.00) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL19958353 0.84 CD40 (1.00) ENPP2PRMT1PRMT3EP300PRMT6
SCHEMBL10623083 0.84 PRMT1 (0.98) ENPP2PRMT1PRMT3EP300PRMT6

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4550014-A1 TRANSLUCENT RESIN SHEET, PROJECTION DISPLAY, AND MOVING BODY Sumitomo Bakelite Co.Ltd. (JP) 2025-05-07 — — EP disclosed
WO-2024005168-A1 TRANSLUCENT RESIN SHEET, PROJECTION DISPLAY, AND MOVING BODY 住友ベークライト株式会社 2024-01-04 — — WO disclosed
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