SCHEMBL10653815

SCHEMBL10653815

COc1cc(Cl)c(C#N)cc1C(=O)NCCNC(C)Cc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 1/20 0.48
▸ TNKS2 Q9H2K2 1/20 0.48
▸ L3MBTL1 Q9Y468 2/20 0.43
▸ ACACB O00763 1/20 0.42
▸ ADRB1 P08588 1/20 0.41
▸ ADRB3 P13945 1/20 0.41
▸ CFTR P13569 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HPGD P15428 2/20 0.41
▸ TP53 P04637 1/20 0.41
▸ GLA P06280 1/20 0.41
▸ SIGMAR1 Q99720 2/20 0.40
▸ PPARA Q07869 2/20 0.39
▸ PPARG P37231 1/20 0.39
▸ LMNA P02545 1/20 0.39

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
SCHEMBL10704054 0.85 WNT3A (0.52) WNT3ATNKS2L3MBTL1CFTRRAB9A
SCHEMBL10657794 0.84 WNT3A (0.49) WNT3ATNKS2L3MBTL1CFTRNPC1
SCHEMBL10706257 0.83 WNT3A (0.48) WNT3ATNKS2L3MBTL1CFTRRAB9A
SCHEMBL10653817 0.82 WNT3A (0.49) WNT3ATNKS2L3MBTL1NPC1RAB9A
SCHEMBL10653820 0.78 MEN1 (0.44) WNT3ATNKS2L3MBTL1NPC1RAB9A
SCHEMBL10658698 0.77 WNT3A (0.55) WNT3ATNKS2L3MBTL1CFTRRAB9A
SCHEMBL10712250 0.77 WNT3A (0.55) WNT3ATNKS2L3MBTL1CFTRRAB9A
SCHEMBL10704073 0.77 WNT3A (0.47) WNT3ATNKS2ACACBRAB9AHPGD
SCHEMBL10658307 0.77 WNT3A (0.51) WNT3ATNKS2RAB9ALMNA
Hydrochloric Acid SCHEMBL10657811 0.76 WNT3A (0.52) WNT3ATNKS2L3MBTL1CFTRRAB9A

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-0183190-B1 BENZAMIDES AND SALTS CIBA-GEIGY AG (CH) 1988-12-28 — — EP disclosed
US-4772630-A ANTIDEPRESSANTS, ANTISCHIZOPHRENIA CIBA-GEIGY CORP. (US) 1988-09-20 — — US disclosed
EP-0183190-A1 Benzamides and salts CIBA-GEIGY AG (CH) 1986-06-04 — — EP disclosed
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