SCHEMBL6946358

SCHEMBL6946358

[NH]c1ccc(/N=N/c2ccc(S(=O)(=O)O)cc2O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RPS6KA3 P51812 1/20 0.56
▸ CYP2C9 P11712 2/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ HSD17B10 Q99714 1/20 0.49
▸ ATIC P31939 1/20 0.49
▸ POLB P06746 3/20 0.49
▸ EGFR P00533 1/20 0.49
▸ CYP2D6 P10635 1/20 0.49
▸ GLO1 Q04760 1/20 0.48
▸ PHLPP2 Q6ZVD8 4/20 0.46
▸ MAPT P10636 4/20 0.46
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ LMNA P02545 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ CYP1A2 P05177 1/20 0.45
▸ CDK1 P06493 1/20 0.44
▸ CDK2 P24941 1/20 0.44

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
SCHEMBL6946360 1.00 RPS6KA3 (0.56) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL6946362 0.84 CA12 (0.57) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL27771162 0.84 POLB (0.66) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL112102 0.83 EGFR (0.69) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL29378452 0.83 EGFR (0.69) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL112101 0.83 EGFR (0.69) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL144370 0.81 EGFR (0.67) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL144372 0.81 EGFR (0.67) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL5364165 0.80 RPS6KA3 (0.62) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC
SCHEMBL31525881 0.77 RPS6KA3 (0.58) RPS6KA3CYP2C9CYP2C19HSD17B10ATIC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1261587-B1 STILBENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTIVIRAL AGENTS UNIV BASEL (CH) 2003-07-16 — — EP disclosed
EP-1261587-A1 STILBENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTIVIRAL AGENTS Universität Basel (CH) 2002-12-04 — — EP disclosed
WO-2001040194-A1 STILBENE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS ANTIVIRAL AGENTS UNIVERSITÄT BASEL (CH) 2001-06-07 — — WO disclosed
Send feedback