SCHEMBL3823632

SCHEMBL3823632

CN1CCN(c2ccc(CN(C(=O)c3ccccc3F)c3ccc(F)cc3)cn2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.45
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 2/20 0.41
KDM4E B2RXH2 1/20 0.41
TSHR P16473 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
DGAT1 O75907 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
ME2 P23368 1/20 0.40
ME1 P48163 1/20 0.40
ME3 Q16798 1/20 0.40
EP300 Q09472 1/20 0.40
TACR1 P25103 1/20 0.39
HTR1A P08908 2/20 0.39
DRD4 P21917 2/20 0.39
HTR2A P28223 2/20 0.39
SLC6A4 P31645 2/20 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
SCHEMBL3827091 0.91 L3MBTL1 (0.44) L3MBTL1ALDH1A1KDM4ETSHRCHRM5
SCHEMBL3860025 0.91 L3MBTL1 (0.53) L3MBTL1RAB9AALDH1A1KDM4ETSHR
SCHEMBL3830922 0.90 L3MBTL1 (0.43) L3MBTL1ALDH1A1KDM4ETSHRCHRM5
SCHEMBL3830332 0.88 MEN1 (0.45) L3MBTL1RAB9AALDH1A1KDM4ETSHR
SCHEMBL4733653 0.87 MAPT (0.42) L3MBTL1RAB9AALDH1A1KDM4ETSHR
SCHEMBL3824125 0.86 L3MBTL1 (0.44) L3MBTL1RAB9AKDM4EOPRM1OPRK1
SCHEMBL4737954 0.86 KDM4E (0.45) L3MBTL1ALDH1A1KDM4ETSHRCHRM5
SCHEMBL3823072 0.84 KDM4E (0.45) L3MBTL1RAB9AKDM4EOPRM1OPRK1
SCHEMBL4735130 0.84 KMT2A (0.45) RAB9AALDH1A1KDM4ETSHROPRM1
SCHEMBL4735586 0.84 LMNA (0.53) L3MBTL1ALDH1A1KDM4ETSHROPRM1

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-2097379-A1 CARBOXAMIDE DERIVATIVES AS ION CHANNEL MODULATORS Wyeth a Corporation of the State of Delaware (US) 2009-09-09 EP claimed
WO-2008073936-A1 CARBOXAMIDE DERIVATIVES AS ION CHANNEL MODULATORS WYETH (US) 2008-06-19 WO claimed