SCHEMBL10787907

SCHEMBL10787907

CCC(CC)(Oc1ccc(C(O)(CC)c2cccc(C(F)(F)F)c2)cc1)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 9/20 0.44
▸ FFAR1 O14842 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.40
▸ NR4A2 P43354 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ EPHX1 P07099 2/20 0.37
▸ MRGPRX4 Q96LA9 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL10356117 0.81 MAOB (0.38) MAOBMAPTL3MBTL1ALDH1A1
SCHEMBL10879067 0.77 FAAH (0.46) MAOBKDM4EALDH1A1POLB
SCHEMBL10877406 0.76 FAAH (0.50) MAOBMRGPRX4ALDH1A1POLB
Flumecinol SCHEMBL667363 0.76 ALDH1A1 (0.45) MAPTHTTL3MBTL1ALDH1A1POLB
SCHEMBL10783493 0.76 NR4A2 (0.55) MAOBFFAR1FFAR4NR4A2MAPT
SCHEMBL10784574 0.75 IDH1 (0.52) MAOBNR4A2MAPTKDM4EALDH1A1
SCHEMBL10881215 0.75 FAAH (0.44) MAOBKDM4EALDH1A1POLB
SCHEMBL10740804 0.75 ESR1 (0.47) MAPTHTTKDM4EALDH1A1POLB
SCHEMBL10356364 0.74 TRPM8 (0.55) MAOBNR4A2MAPTKDM4EALDH1A1
SCHEMBL10877636 0.74 ALDH1A1 (0.51) ALDH1A1POLB

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-0116787-B1 1,1-DIPHENYLPROPANOL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Richter Gedeon Vegyészeti Gyár R.T. (HU) 1987-03-18 — — EP disclosed
EP-0116787-A1 1,1-Diphenylpropanol derivatives, process for their preparation and pharmaceutical compositions containing them Richter Gedeon Vegyészeti Gyár R.T. (HU) 1984-08-29 — — EP disclosed
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