SCHEMBL7813050

SCHEMBL7813050

Cc1cc(/N=N/c2ccc(S(=O)(=O)O)cc2)ccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 1/20 0.63
▸ PHLPP2 Q6ZVD8 4/20 0.62
▸ POLB P06746 1/20 0.56
▸ CYP2D6 P10635 1/20 0.56
▸ BRD4 O60885 2/20 0.55
▸ PTGS2 P35354 4/20 0.54
▸ PTGS1 P23219 4/20 0.54
▸ CYP2C9 P11712 2/20 0.53
▸ CYP1A2 P05177 1/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ NPC1 O15118 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ HSP90AA1 P07900 1/20 0.53
▸ ATIC P31939 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MAPT P10636 2/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ KDM4E B2RXH2 1/20 0.48

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
SCHEMBL7813054 1.00 RPS6KA3 (0.63) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL8843749 0.86 PHLPP2 (0.75) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL8843743 0.86 PHLPP2 (0.75) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL4280752 0.84 PTGS1 (0.74) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL12486693 0.83 RPS6KA3 (0.62) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL12486691 0.83 RPS6KA3 (0.62) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL5357061 0.82 RPS6KA3 (0.58) RPS6KA3PHLPP2POLBCYP2D6BRD4
SCHEMBL6256568 0.82 KMT2A (0.71) POLBCYP2D6BRD4PTGS2PTGS1
SCHEMBL6256564 0.82 KMT2A (0.71) POLBCYP2D6BRD4PTGS2PTGS1
SCHEMBL12486810 0.81 RPS6KA3 (0.56) RPS6KA3PHLPP2POLBCYP2D6PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5618726-A DYE HAVING LIGNIN-LIKE SUBSTITUTION PATTERN AND A MICROBE CAPABLE OF PRODUCING EXTRACELLULAR PEROXIDASE IDAHO RESEARCH FOUNDATION, INC. (US) 1997-04-08 — — US claimed
WO-1992017550-A1 BIODEGRADABLE AZO DYES IDAHO RESEARCH FOUNDATION, INC. (US) 1992-10-15 — — WO claimed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 — — EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 — — WO disclosed
US-5618726-A DYE HAVING LIGNIN-LIKE SUBSTITUTION PATTERN AND A MICROBE CAPABLE OF PRODUCING EXTRACELLULAR PEROXIDASE IDAHO RESEARCH FOUNDATION, INC. (US) 1997-04-08 — — US disclosed
US-5486214-A MONO OR DISAZO DYES, LIGNIN PEROXIDASE AND VERATRYL ALCOHOL MIXTURE FOR DEGRADATION OF DYES IDAHO RESEARCH FOUNDATION, INC. (US) 1996-01-23 — — US disclosed
WO-1992017550-A1 BIODEGRADABLE AZO DYES IDAHO RESEARCH FOUNDATION, INC. (US) 1992-10-15 — — WO disclosed
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