SCHEMBL9778693

SCHEMBL9778693

Cc1ccc(COc2cccc(C3SCCS3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOB P27338 14/20 0.56
MAOA P21397 4/20 0.55
NPC1 O15118 2/20 0.48
RAB9A P51151 2/20 0.48
HPD P32754 1/20 0.44
GPR18 Q14330 1/20 0.43
GPR55 Q9Y2T6 1/20 0.43
APP P05067 1/20 0.41
NR1H4 Q96RI1 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL9778499 0.95 MAOB (0.54) MAOBMAOANPC1RAB9AHPD
SCHEMBL9778609 0.85 MAOB (0.40) MAOBMAOANPC1RAB9AAPP
SCHEMBL9778784 0.83 NPC1 (0.53) MAOBNPC1RAB9AAPPTDP1
SCHEMBL9778677 0.82 MAPT (0.56) MAOBMAOANPC1RAB9A
SCHEMBL9778556 0.82 KDM1A (0.49) MAOBMAOA
SCHEMBL9778898 0.82 MAOB (0.39) MAOBMAOAAPP
SCHEMBL9778719 0.81 NR4A2 (0.48) MAOBMAOAHPDGPR18GPR55
SCHEMBL9778819 0.77 MAPT (0.51) MAOBMAOANPC1RAB9A
SCHEMBL9778586 0.76 MAOB (0.54) MAOBMAOANPC1RAB9AHPD
SCHEMBL12182456 0.75 MAOB (0.74) MAOBMAOANPC1RAB9AHPD

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-5063197-A Aromatic compound MITSUBISHI PAPER MILLS LIMITED (JP) 1991-11-05 US disclosed