SCHEMBL7395385

SCHEMBL7395385

COc1ccc(Oc2c(CNCC(=O)O)sc3cc(OC)c(OC)cc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 2/20 0.46
▸ STING1 Q86WV6 3/20 0.45
▸ LMNA P02545 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ SERPINE1 P05121 2/20 0.38
▸ ICAM1 P05362 1/20 0.37
▸ SELE P16581 1/20 0.37
▸ CCNC P24863 1/20 0.37
▸ CDK8 P49336 1/20 0.37
▸ TUBB4A P04350 2/20 0.36
▸ TUBB P07437 2/20 0.36
▸ TUBA3C P0DPH7 2/20 0.36
▸ TUBA1B P68363 2/20 0.36
▸ TUBA4A P68366 2/20 0.36
▸ TUBB4B P68371 2/20 0.36
▸ TUBB3 Q13509 2/20 0.36
▸ TUBB2A Q13885 2/20 0.36
▸ TUBB8 Q3ZCM7 2/20 0.36
▸ TUBA3E Q6PEY2 2/20 0.36
▸ TUBA1A Q71U36 2/20 0.36

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
SCHEMBL8180444 0.89 L3MBTL1 (0.44) L3MBTL1STING1LMNAMAPTSERPINE1
SCHEMBL7394624 0.85 STING1 (0.50) L3MBTL1STING1MAPTSERPINE1TUBB4A
SCHEMBL7399212 0.83 L3MBTL1 (0.43) L3MBTL1STING1LMNAMAPTSERPINE1
SCHEMBL7444160 0.81 CA1 (0.48) L3MBTL1MAPTTUBB4ATUBBTUBA3C
SCHEMBL8175655 0.80 CA1 (0.47) L3MBTL1MAPTTUBB4ATUBBTUBA3C
SCHEMBL7395401 0.80 L3MBTL1 (0.51) L3MBTL1STING1SERPINE1ICAM1SELE
SCHEMBL7431686 0.79 AKR1C3 (0.43) L3MBTL1MAPTMEN1KMT2A
SCHEMBL7393277 0.79 PPARA (0.52) L3MBTL1LMNAMAPTMEN1KMT2A
SCHEMBL8174950 0.79 AKR1C3 (0.43) L3MBTL1MAPTMEN1KMT2A
SCHEMBL7431728 0.78 ALDH1A1 (0.46) SERPINE1KMT2A

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-0955299-B1 Benzothiophene, benzofurane and indole derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2002-03-13 — — EP 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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