SCHEMBL9547737

SCHEMBL9547737

CC(=O)OC(C)c1ccc(OCc2ccccc2)cc1F

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.50
MRGPRX4 Q96LA9 1/20 0.47
MAOA P21397 1/20 0.46
FFAR1 O14842 3/20 0.46
PPARD Q03181 2/20 0.46
ALOX5 P09917 1/20 0.45
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NR4A2 P43354 1/20 0.44

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
SCHEMBL27577519 0.83 MAOB (0.50) MAOBMRGPRX4MAOAFFAR1LMNA
SCHEMBL28785862 0.82 MRGPRX4 (0.48) MAOBMRGPRX4L3MBTL1
SCHEMBL15472489 0.81 ALOX5 (0.56) MAOBMRGPRX4MAOAALOX5LMNA
SCHEMBL28123955 0.79 MAOB (0.49) MAOBMRGPRX4MAOAFFAR1PPARD
SCHEMBL5045302 0.79 MRGPRX4 (0.48) MAOBMRGPRX4MAOAFFAR1PPARD
SCHEMBL9127224 0.79 ALOX5 (0.54) MAOBMRGPRX4ALOX5
SCHEMBL27577521 0.78 MAOB (0.47) MAOBMRGPRX4MAOAALOX5
SCHEMBL28343888 0.78 ALOX5 (0.47) MAOBMRGPRX4FFAR1PPARDALOX5
SCHEMBL28343890 0.78 ALOX5 (0.47) MAOBMRGPRX4FFAR1PPARDALOX5
SCHEMBL27821048 0.78 KMT2A (0.46) MAOBALOX5LMNAL3MBTL1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0288297-B1 OPTICALLY ACTIVE BENZENE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-03-17 EP disclosed
US-4985590-A Optically active benzene derivatives and process for preparation thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-01-15 US disclosed