SCHEMBL3264659

SCHEMBL3264659

COCC(O)(CCNC(C)c1ccc(Br)cc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
CYP3A4 P08684 2/20 0.38
SLC6A4 P31645 2/20 0.38
CHRM2 P08172 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
CHRM1 P11229 1/20 0.38
SMPD1 P17405 1/20 0.38
DRD1 P21728 1/20 0.38
TBXA2R P21731 1/20 0.38
SLC6A2 P23975 1/20 0.38
ADRA1A P35348 1/20 0.38
OPRM1 P35372 1/20 0.38
DRD3 P35462 1/20 0.38
CASR P41180 1/20 0.38
HTR2B P41595 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KCNH2 Q12809 1/20 0.38

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
SCHEMBL118040 1.00 LMNA (0.40) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL13953706 0.88 CYP3A4 (0.38) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL16791656 0.86 SMN1; SMN2 (0.42) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL15674698 0.84 SMN1; SMN2 (0.40) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL117417 0.84 SMN1; SMN2 (0.40) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL10066477 0.84 SMN1; SMN2 (0.40) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL3192627 0.77 SIGMAR1 (0.39) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL1850432 0.77 DRD2 (0.43) SMN1; SMN2OPRM1DRD3KMT2AMEN1
SCHEMBL1902599 0.74 SMN1; SMN2 (0.43) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2
SCHEMBL5468813 0.73 LMNA (0.61) LMNASMN1; SMN2CYP3A4SLC6A4CHRM2

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
WO-2010010157-A2 INHIBITORS OF 11beta-HYDROXYSTEROID DEHYDROGENASE 1 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-01-28 WO disclosed