SCHEMBL10653820

SCHEMBL10653820

COc1cc(Cl)c(C#N)cc1C(=O)NC(C)NCCCc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ WNT3A P56704 1/20 0.42
▸ TNKS2 Q9H2K2 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ TAS1R3 Q7RTX0 1/20 0.40
▸ TAS1R1 Q7RTX1 1/20 0.40
▸ SCN9A Q15858 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ SIGMAR1 Q99720 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
SCHEMBL10706573 0.84 WNT3A (0.44) MEN1KMT2ALMNAMAPTWNT3A
SCHEMBL10653817 0.83 WNT3A (0.49) L3MBTL1MAPTWNT3ATNKS2POLB
SCHEMBL10653815 0.78 WNT3A (0.48) L3MBTL1LMNAMAPTWNT3ATNKS2
SCHEMBL10706251 0.74 WNT3A (0.41) MEN1KMT2ALMNAMAPTWNT3A
SCHEMBL10704054 0.73 WNT3A (0.52) MEN1KMT2AL3MBTL1LMNAWNT3A
SCHEMBL10704067 0.73 WNT3A (0.44) MEN1KMT2ALMNAMAPTWNT3A
SCHEMBL10658307 0.70 WNT3A (0.51) LMNAWNT3ATNKS2RAB9A
SCHEMBL10704073 0.70 WNT3A (0.47) MEN1KMT2ALMNAWNT3ATNKS2
SCHEMBL10658698 0.69 WNT3A (0.55) L3MBTL1LMNAWNT3ATNKS2RAB9A
SCHEMBL10712250 0.69 WNT3A (0.55) L3MBTL1LMNAWNT3ATNKS2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4772630-A ANTIDEPRESSANTS, ANTISCHIZOPHRENIA CIBA-GEIGY CORP. (US) 1988-09-20 — — US disclosed
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