SCHEMBL7375486

SCHEMBL7375486

CC1CN(Cc2ccccc2Cl)CC(CCl)O1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.78
HTT P42858 2/20 0.78
CYP2A13 Q16696 3/20 0.62
TDP1 Q9NUW8 1/20 0.55
SIGMAR1 Q99720 1/20 0.44
CXCR4 P61073 3/20 0.43
ALDH1A1 P00352 5/20 0.42
PLA2G1B P04054 1/20 0.42
RAB9A P51151 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
ATM Q13315 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GAA P10253 2/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL7372983 0.88 KDM4E (1.00) KDM4EHTTCYP2A13TDP1SIGMAR1
SCHEMBL7376116 0.88 KDM4E (0.76) KDM4EHTTCYP2A13TDP1SIGMAR1
SCHEMBL7370974 0.80 KDM4E (0.64) KDM4EHTTCYP2A13TDP1CXCR4
SCHEMBL7371482 0.80 KDM4E (0.64) KDM4EHTTCYP2A13TDP1ALDH1A1
SCHEMBL13850015 0.77 CYP2A13 (1.00) KDM4EHTTCYP2A13TDP1CXCR4
SCHEMBL18360700 0.74 KDM4E (0.69) KDM4EHTTCYP2A13TDP1SIGMAR1
SCHEMBL9161601 0.73 KDM4E (0.67) KDM4EHTTCYP2A13TDP1ALDH1A1
SCHEMBL9163382 0.73 KDM4E (0.67) KDM4EHTTCYP2A13TDP1ALDH1A1
SCHEMBL9390972 0.73 KDM4E (0.67) KDM4EHTTCYP2A13TDP1ALDH1A1
SCHEMBL31024625 0.71 KDM4E (0.51) KDM4EHTTCYP2A13SIGMAR1GAA

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-0243959-B1 SUBSTITUTED BENZAMIDE DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME Dainippon Pharmaceutical Co., Ltd. (JP) 1992-08-19 EP disclosed
US-4870074-A Substituted benzamide derivatives, for enhancing gastrointestinal motility DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1989-09-26 US disclosed
EP-0243959-A1 Substituted benzamide derivatives, processes for the preparation thereof, and pharmaceutical compositions containing the same Dainippon Pharmaceutical Co., Ltd. (JP) 1987-11-04 EP disclosed