SCHEMBL7394341

SCHEMBL7394341

COc1ccc(Oc2c(CN(CC(=O)O)c3ccccc3)sc3cc(OC)c(OC)cc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KEAP1 Q14145 8/20 0.40
▸ NFE2L2 Q16236 7/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ STING1 Q86WV6 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ DYRK1A Q13627 1/20 0.36
▸ CNR2 P34972 2/20 0.36
▸ RNF4 P78317 1/20 0.35
▸ PTGDR2 Q9Y5Y4 1/20 0.35
▸ SERPINE1 P05121 1/20 0.35
▸ NPBWR1 P48145 1/20 0.35
▸ PTPN1 P18031 1/20 0.35

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
SCHEMBL8179574 0.91 L3MBTL1 (0.40) KEAP1NFE2L2L3MBTL1STING1MAPT
SCHEMBL8175134 0.90 PPARG (0.44) L3MBTL1MAPTSMN1; SMN2CNR2RNF4
SCHEMBL7393894 0.82 DYRK1A (0.42) KEAP1NFE2L2L3MBTL1STING1DYRK1A
SCHEMBL7394624 0.79 STING1 (0.50) L3MBTL1STING1MAPTSERPINE1
SCHEMBL6177057 0.79 SERPINE1 (0.56) SERPINE1
SCHEMBL6177204 0.76 POLB (0.36) KEAP1NFE2L2L3MBTL1MAPTPTGDR2
SCHEMBL7397312 0.76 FABP4 (0.39) KEAP1NFE2L2L3MBTL1DYRK1A
SCHEMBL7395385 0.76 L3MBTL1 (0.46) L3MBTL1STING1MAPTSERPINE1
SCHEMBL8176254 0.76 L3MBTL1 (0.41) L3MBTL1STING1MAPTCNR2NPBWR1
SCHEMBL7395401 0.75 L3MBTL1 (0.51) L3MBTL1STING1CNR2SERPINE1

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-0955299-B1 Benzothiophene, benzofurane and indole derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-03-13 — — EP disclosed
US-6048875-A CARDIOVASCULAR DISORDERS; REDUCING THROMBOSIS ADIR ET COMPAGNIE (FR) 2000-04-11 — — US disclosed
EP-0955299-A1 Benzothiophene, benzofurane and indole derivatives, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1999-11-10 — — EP disclosed
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