SCHEMBL9831468

SCHEMBL9831468

CN1C(=O)C(Sc2ccccc2)(c2ccc(O)cc2)Sc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.41
GPR55 Q9Y2T6 2/20 0.41
PKM P14618 2/20 0.41
ALDH1A1 P00352 5/20 0.33
MAPT P10636 4/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 2/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
MAOA P21397 1/20 0.33
GAA P10253 1/20 0.32
GFER P55789 1/20 0.32
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C19 P33261 1/20 0.32
RAB9A P51151 1/20 0.32
ADAMTS5 Q9UNA0 1/20 0.32

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
SCHEMBL9831057 0.86 CNR1 (0.44) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9831187 0.78 CNR1 (0.43) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL10669282 0.77 CNR1 (0.44) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9830460 0.77 CNR1 (0.44) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9828953 0.74 CNR1 (0.42) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9829469 0.73 CNR1 (0.41) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9829132 0.72 CNR1 (0.40) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9831101 0.70 CNR1 (0.38) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9831087 0.68 CNR1 (0.37) CNR1GPR55PKMALDH1A1MAPT
SCHEMBL9829983 0.68 CYP1A2 (0.40) CNR1GPR55PKMALDH1A1MAPT

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-0233291-B1 2-ARYLBENZOTHIAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1991-03-13 EP disclosed
US-4739050-A CALCIUM ANTAGONIST, ANTICOAGULANT SANTEN PHARMACEUTICAL CO., LTD. (JP) 1988-04-19 US disclosed
EP-0233291-A1 2-ARYLBENZOTHIAZINE DERIVATIVES SANTEN PHARMACEUTICAL CO., LTD. (JP) 1987-08-26 EP disclosed