SCHEMBL9315545

SCHEMBL9315545

CN(C)c1cccc(OCC(=O)c2cccc(Cl)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.47
MAOA P21397 1/20 0.46
MAOB P27338 1/20 0.46
POLB P06746 2/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
BLM P54132 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NR4A2 P43354 1/20 0.44
WDR5 P61964 1/20 0.43
ERCC5 P28715 1/20 0.43
FEN1 P39748 1/20 0.43
GRM4 Q14833 1/20 0.43
MAPT P10636 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HTT P42858 2/20 0.43
MAPK1 P28482 1/20 0.43
MCL1 Q07820 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MEN1 O00255 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
SCHEMBL9315508 0.95 KDM4E (0.50) KDM4EMAOAMAOBPOLBNPC1
SCHEMBL9315524 0.88 NPC1 (0.49) MAOAMAOBPOLBNPC1RAB9A
SCHEMBL9948498 0.82 ERCC5 (0.55) POLBNPC1RAB9ABLMSMN1; SMN2
SCHEMBL9316487 0.80 ALOX5 (0.47) KDM4EMAOAMAOBPOLBNR4A2
SCHEMBL9368178 0.79 RAB9A (0.52) KDM4EMAOAMAOBPOLBNPC1
SCHEMBL9786924 0.79 MAPT (0.61) KDM4ENPC1RAB9ASMN1; SMN2NR4A2
SCHEMBL9576423 0.79 KDM4E (0.53) KDM4EMAOBPOLBNPC1RAB9A
SCHEMBL9316025 0.78 KMT2A (0.57) MAOAMAOBPOLBNPC1RAB9A
SCHEMBL29955055 0.77 LMNA (0.63) KDM4EALDH1A1HTTMAPK1MCL1
SCHEMBL7996336 0.77 LMNA (0.63) KDM4EALDH1A1HTTMAPK1MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5177111-A Analgesic HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-01-05 US claimed
US-5300527-A Administering anticholinergic agents for treating the memory dysfunction HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-04-05 US disclosed
US-5177111-A Analgesic HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1993-01-05 US disclosed
EP-0432719-A1 Alkylamino- and alkylaminoalkyl diarylketones, a process for their preparation and their use as medicaments HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1991-06-19 EP disclosed
US-5006563-A Alzheimer's disease HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1991-04-09 US disclosed