SCHEMBL7752926

SCHEMBL7752926

CCc1ccc2c(c1)CC(=O)O2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAOA P21397 4/20 0.46
MAOB P27338 4/20 0.46
PARP1 P09874 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.37
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ATM Q13315 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
SCHEMBL14290105 0.86 MAOA (0.40) MAOAMAOB
SCHEMBL14050228 0.86 PARP1 (0.41) MAOAMAOBPARP1L3MBTL1NPC1
SCHEMBL6838708 0.84 PARP1 (0.43) MAOBPARP1L3MBTL1NPC1ALDH1A1
SCHEMBL18656435 0.82 MAOA (0.38) MAOAMAOBPARP1ALDH1A1
SCHEMBL7421095 0.82 MAOA (0.42) MAOAMAOB
SCHEMBL18642103 0.82 MAOA (0.42) MAOAMAOB
SCHEMBL18656438 0.81 MAOA (0.40) MAOAMAOBPARP1SMN1; SMN2
SCHEMBL29506700 0.81 HTR2A (0.44) ALDH1A1LMNA
SCHEMBL28695323 0.81 HTR2A (0.44) ALDH1A1LMNA
SCHEMBL16667216 0.78 MAPT (0.50) MAOAMAOBALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721947-B1 Alkyl(hetero)cyclic compounds, process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-03-14 EP disclosed
US-5703121-A SLEEP DISORDERS ADIR ET COMPAGNIE (FR) 1997-12-30 US disclosed
EP-0721947-A1 Alkyl(hetero)cyclic compounds, process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1996-07-17 EP disclosed