SCHEMBL10463097

SCHEMBL10463097

CCCCCCCOc1ccc(-c2ccc(CCc3ccc(CC)cn3)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 1/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ MAPT P10636 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ RARB P10826 3/20 0.47
▸ CYP3A4 P08684 4/20 0.47
▸ CYP2D6 P10635 2/20 0.47
▸ PPARG P37231 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.45
▸ KDM4E B2RXH2 2/20 0.45
▸ HPGD P15428 2/20 0.45
▸ HTT P42858 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ LMNA P02545 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CASP1 P29466 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ SLCO1B3 Q9NPD5 1/20 0.45

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
SCHEMBL10461697 1.00 MCHR1 (0.54) MCHR1L3MBTL1MAPTRAB9ARARB
SCHEMBL10462396 1.00 MCHR1 (0.54) MCHR1L3MBTL1MAPTRAB9ARARB
SCHEMBL10459660 1.00 MCHR1 (0.54) MCHR1L3MBTL1MAPTRAB9ARARB
SCHEMBL10462469 0.99 MCHR1 (0.55) MCHR1L3MBTL1MAPTRAB9ARARB
SCHEMBL10460099 0.96 MCHR1 (0.57) MCHR1L3MBTL1MAPTRAB9ACYP3A4
SCHEMBL10461875 0.96 PPARG (0.48) MCHR1L3MBTL1MAPTRAB9ACYP3A4
SCHEMBL10461725 0.96 PPARG (0.48) MCHR1L3MBTL1MAPTRAB9ACYP3A4
SCHEMBL10463121 0.96 PPARG (0.48) MCHR1L3MBTL1MAPTRAB9ACYP3A4
SCHEMBL10462806 0.96 PPARG (0.48) MCHR1L3MBTL1MAPTRAB9ACYP3A4
SCHEMBL10462372 0.95 PPARG (0.49) MCHR1L3MBTL1MAPTRAB9ACYP3A4

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-4913837-A Heterocyclic compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-04-03 — — US disclosed
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