SCHEMBL9503986

SCHEMBL9503986

CN(C)c1ccc(C(CC(=O)c2ccc(F)cc2)CC(=O)c2ccc(F)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.56
APP P05067 2/20 0.51
ALDH1A1 P00352 4/20 0.46
MAPT P10636 4/20 0.46
POLB P06746 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.46
GAA P10253 2/20 0.45
MEN1 O00255 2/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 1/20 0.45
TP53 P04637 1/20 0.45
SNCA P37840 1/20 0.45
BRCA1 P38398 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HPGD P15428 1/20 0.44
DRD2 P14416 1/20 0.44
CBX7 O95931 1/20 0.43
CDYL2 Q8N8U2 1/20 0.43
CDYL Q9Y232 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
SCHEMBL9505825 0.86 ALDH1A1 (0.49) KMT2AALDH1A1MAPTPOLBL3MBTL1
SCHEMBL9503695 0.85 POLB (0.54) KMT2AALDH1A1MAPTPOLBL3MBTL1
SCHEMBL9505856 0.84 L3MBTL1 (0.63) KMT2AALDH1A1MAPTPOLBL3MBTL1
SCHEMBL9503965 0.82 L3MBTL1 (0.69) KMT2AALDH1A1MAPTL3MBTL1GAA
SCHEMBL9507663 0.78 KMO (0.51) ALDH1A1L3MBTL1GAA
SCHEMBL10516691 0.76 APP (0.55) KMT2AAPPALDH1A1MAPTPOLB
SCHEMBL22448583 0.75 ALDH1A1 (0.55) KMT2AALDH1A1MAPTPOLBL3MBTL1
SCHEMBL11279441 0.75 ALDH1A1 (0.71) KMT2AAPPALDH1A1MAPTL3MBTL1
SCHEMBL11279438 0.75 ALDH1A1 (0.71) KMT2AAPPALDH1A1MAPTL3MBTL1
SCHEMBL9292264 0.75 MAPT (0.79) KMT2AAPPALDH1A1MAPTPOLB

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-0395991-B1 3-AMINOPHENYL-1,5-PENTANEDIONES BASF Aktiengesellschaft (DE) 1993-06-23 EP disclosed
US-5053524-A Intermediate for synthesis of triphenylcyclopentadiene dyes BASF AKTIENGESELLSCHAFT (DE) 1991-10-01 US disclosed
EP-0395991-A1 3-Aminophenyl-1,5-pentanediones BASF Aktiengesellschaft (DE) 1990-11-07 EP disclosed