SCHEMBL30399352

SCHEMBL30399352

O=Cc1ccc(OCc2cccc(Cl)c2)cc1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.65
RXRA P19793 1/20 0.62
RXRB P28702 1/20 0.62
RXRG P48443 1/20 0.62
RAB9A P51151 1/20 0.61
MAOA P21397 4/20 0.61
ALOX5 P09917 1/20 0.56
MAPK1 P28482 1/20 0.54
NR4A2 P43354 1/20 0.54
DHFR P00374 1/20 0.53
GID4 Q8IVV7 1/20 0.53

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
SCHEMBL3423658 1.00 MAOB (0.65) MAOBRXRARXRBRXRGRAB9A
SCHEMBL8545870 0.89 RAB9A (0.71) MAOBRAB9AMAOA
SCHEMBL31384348 0.88 MAOB (0.56) MAOBRXRARXRBRXRGMAOA
SCHEMBL8985654 0.86 MAOB (0.72) MAOBRXRARXRBRXRGRAB9A
SCHEMBL4417316 0.84 MAOB (0.65) MAOBRXRARXRBRXRGMAOA
SCHEMBL28115794 0.84 MAOB (0.69) MAOBRXRARXRBRXRGMAOA
SCHEMBL18002417 0.83 MAOB (0.68) MAOBRXRARXRBRXRGRAB9A
SCHEMBL27983208 0.83 RAB9A (0.63) MAOBRAB9AMAOA
SCHEMBL12578102 0.81 RAB9A (0.55) MAOBRAB9AMAOA
SCHEMBL1164139 0.81 MAOB (0.74) MAOBRAB9AMAOANR4A2

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-110240557-B Pyrrolidine amide derivatives and use thereof 广东东阳光药业有限公司 2023-05-09 CN disclosed