SCHEMBL10966476

SCHEMBL10966476

OCc1cc(Cl)cc2c3c(oc12)CCC3

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 2/20 0.39
▸ MAOB P27338 1/20 0.39
▸ HTR6 P50406 6/20 0.38
▸ MAPK1 P28482 2/20 0.37
▸ TSHR P16473 1/20 0.37
▸ HTT P42858 1/20 0.37
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ THRB P10828 1/20 0.34
▸ KDM4E B2RXH2 5/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.32
▸ GAA P10253 3/20 0.31
▸ LMNA P02545 1/20 0.31
▸ BCHE P06276 1/20 0.31
▸ ACHE P22303 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2A Q12879 1/20 0.31

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
SCHEMBL11292349 0.81 HTR6 (0.43) MAOAMAOBHTR6MAPK1TSHR
SCHEMBL11283989 0.76 MAOA (0.42) MAOAMAOBHTR6MAPK1TSHR
SCHEMBL11295359 0.75 MAOA (0.38) MAOAMAOBMAPK1TSHRHTT
SCHEMBL7334850 0.71 TSHR (0.42) MAOAMAOBMAPK1TSHRHTT
SCHEMBL11284099 0.67 HTR6 (0.38) MAOAMAOBHTR6MAPK1TSHR
SCHEMBL4166365 0.66 PTGER1 (0.53) MAOAMAOBCYP1A2MAPTBCHE
SCHEMBL4166982 0.63 PTGER1 (0.55) MAOAMAOBACHE
SCHEMBL2313299 0.61 LMNA (0.45) TSHRCYP1A2KDM4EGAALMNA
SCHEMBL11292287 0.61 MAOA (0.44) MAOAMAOBMAPK1TSHRHTT
SCHEMBL12071472 0.60 FFAR4 (0.38) MAOAMAOBMAPK1CYP1A2CYP3A4

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
EP-0060640-B1 5,6,7-TRINOR-4,8-INTER-M-PHENYLENE PGI DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM TORAY INDUSTRIES, INC. (JP) 1985-11-13 — — EP disclosed
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