SCHEMBL27771260

SCHEMBL27771260

Cc1cccc(COc2ccc(O)c(C(=O)Nc3cc(Cl)ccn3)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FADS1 O60427 2/20 0.52
▸ MAOB P27338 6/20 0.50
▸ MAOA P21397 3/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ PRMT5 O14744 1/20 0.50
▸ KCNMA1 Q12791 1/20 0.49
▸ NR3C2 P08235 1/20 0.45
▸ NPC1 O15118 3/20 0.45
▸ RAB9A P51151 3/20 0.45
▸ PKM P14618 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ NR1H4 Q96RI1 2/20 0.45
▸ GRM5 P41594 1/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ SORT1 Q99523 1/20 0.43
▸ SPHK2 Q9NRA0 1/20 0.43
▸ SPHK1 Q9NYA1 1/20 0.43

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
SCHEMBL27771246 0.87 FADS1 (0.57) FADS1MAOBMAOAKDM4ENPC1
SCHEMBL27792361 0.84 KCNMA1 (0.66) FADS1MAOBMAOAKDM4EKCNMA1
SCHEMBL13812595 0.82 P2RX1 (0.60) FADS1MAOBMAOANR1H4SPHK2
SCHEMBL14156888 0.78 KDM4E (0.57) MAOBKDM4EPRMT5NR3C2RAB9A
SCHEMBL27771283 0.77 FADS1 (0.67) FADS1MAOBMAOANPC1RAB9A
SCHEMBL13812903 0.76 KCNMA1 (0.55) KDM4EKCNMA1NPC1RAB9ASMN1; SMN2
SCHEMBL28784923 0.76 MAOB (0.46) FADS1MAOBMAOA
SCHEMBL27771252 0.76 KCNMA1 (0.65) FADS1MAOBMAOAKCNMA1NPC1
SCHEMBL27771238 0.75 MAOB (0.54) MAOBMAOAKDM4ENPC1RAB9A
SCHEMBL13812651 0.75 P2RX1 (0.62) FADS1KCNMA1NR1H4

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
CN-101648919-A 3-substituted salicylamide compound, preparation method, medicinal composition and application thereof INST MATERIA MEDICA CAMS 2010-02-17 — — CN disclosed
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