SCHEMBL7653470

SCHEMBL7653470

CC(O)C(N1CCN(C/C=C/c2ccccc2)CC1)n1c2ccc(Br)cc2c2cc(Br)ccc21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 9/20 0.47
GAA P10253 4/20 0.47
MAPK1 P28482 4/20 0.47
HIF1A Q16665 4/20 0.47
ALDH1A1 P00352 4/20 0.47
CYP3A4 P08684 3/20 0.47
CYP2D6 P10635 3/20 0.47
OPRM1 P35372 3/20 0.47
NPSR1 Q6W5P4 3/20 0.47
CYP1A2 P05177 2/20 0.47
CYP2C9 P11712 2/20 0.47
CHRM2 P08172 2/20 0.47
CHRM4 P08173 2/20 0.47
HTR1A P08908 2/20 0.47
CHRM5 P08912 2/20 0.47
ADRA2A P08913 2/20 0.47
ADORA3 P0DMS8 2/20 0.47
CHRM1 P11229 2/20 0.47
DRD2 P14416 2/20 0.47
ADRA2B P18089 2/20 0.47

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
SCHEMBL7649586 0.88 LMNA (0.49) LMNAGAAMAPK1HIF1AALDH1A1
SCHEMBL7649914 0.82 IGF1R (0.47) LMNAGAAMAPK1ALDH1A1CYP3A4
SCHEMBL607711 0.80 MEN1 (0.62) LMNAGAAMAPK1HIF1AALDH1A1
SCHEMBL607710 0.80 MEN1 (0.62) LMNAGAAMAPK1HIF1AALDH1A1
SCHEMBL7652485 0.79 RAD52 (0.39) LMNAGAAMAPK1HIF1AALDH1A1
SCHEMBL7652227 0.78 MEN1 (0.46) LMNAGAACYP3A4CYP2D6CYP1A2
SCHEMBL7647658 0.77 CARM1 (0.50) MAPK1CYP3A4MAPTSMN1; SMN2MEN1
SCHEMBL7649502 0.76 MEN1 (0.47) MAPK1CYP3A4MAPTSMN1; SMN2MEN1
SCHEMBL7652515 0.75 MAPT (0.53) LMNAMAPK1ALDH1A1CYP3A4NPSR1
SCHEMBL7647940 0.74 SMN1; SMN2 (0.40) MAPK1ALDH1A1CYP3A4DRD2DRD1

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-1237887-A1 9-(PIPERAZINYLALKYL)CARBAZOLES AS BAX-MODULATORS Applied Research Systems ARS Holding N.V. (AN) 2002-09-11 EP claimed
WO-2001029028-A1 9- (PIPERAZINYLALKYL) CARBAZOLES AS BAX-MODULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-26 WO claimed