SCHEMBL8073736

SCHEMBL8073736

OC(CCCl)(c1ccccc1)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.53
CHRM3 P20309 13/20 0.48
CHRM4 P08173 12/20 0.48
CHRM2 P08172 11/20 0.48
CHRM5 P08912 11/20 0.48
CHRM1 P11229 11/20 0.48
KCNH2 Q12809 3/20 0.48
CYP2D6 P10635 3/20 0.48
HTR1A P08908 2/20 0.48
OPRM1 P35372 2/20 0.48
LMNA P02545 2/20 0.48
BCL2 P10415 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
HTR2A P28223 2/20 0.46
KDM4E B2RXH2 1/20 0.46
DRD2 P14416 1/20 0.46
DRD1 P21728 1/20 0.46
DRD3 P35462 1/20 0.46
SCN1A P35498 1/20 0.46
SCN2A Q99250 1/20 0.46

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
SCHEMBL5726192 0.86 CHRM4 (0.55) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5
SCHEMBL560935 0.85 SMN1; SMN2 (0.61) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5
SCHEMBL4431781 0.80 SIGMAR1 (0.66) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5
SCHEMBL9661051 0.80 CYP2C9 (0.47) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5
SCHEMBL11602752 0.80 KIF11 (0.54) SMN1; SMN2KCNH2CYP2D6CYP2C9CYP2C19
SCHEMBL301346 0.78 SMN1; SMN2 (0.55) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5
SCHEMBL117473 0.77 CYP2C19 (0.43) SMN1; SMN2LMNACYP2C9CYP2C19CYP1A2
SCHEMBL28986870 0.77 KCNN4 (0.42) SMN1; SMN2LMNABCL2KDM4EMAPK1
SCHEMBL11868000 0.77 BCL2 (0.49) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5
SCHEMBL4862217 0.76 SMN1; SMN2 (0.59) SMN1; SMN2CHRM3CHRM4CHRM2CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1020449-A1 IMIDAZOLINE COMPOUNDS Mitsubishi-Tokyo Pharmaceuticals, Inc. (JP) 2000-07-19 EP disclosed