SCHEMBL7647658

SCHEMBL7647658

CNCC(O)CN1CCN(C(C(C)O)n2c3ccc(Br)cc3c3cc(Br)ccc32)CC1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 9/20 0.50
BAX Q07812 1/20 0.46
MAPT P10636 2/20 0.46
TP53 P04637 1/20 0.46
CYP3A4 P08684 1/20 0.46
ALOX15 P16050 1/20 0.46
MAPK1 P28482 1/20 0.46
MEN1 O00255 1/20 0.44
RAD52 P43351 1/20 0.44
KMT2A Q03164 1/20 0.44
PRMT6 Q96LA8 2/20 0.42
PRMT1 Q99873 1/20 0.42
DNM1 Q05193 6/20 0.41
RECQL P46063 1/20 0.39
SMN1; SMN2 Q16637 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
SCHEMBL609683 0.82 BAX (0.67) CARM1BAXMAPTTP53CYP3A4
SCHEMBL7652515 0.79 MAPT (0.53) BAXMAPTTP53CYP3A4ALOX15
SCHEMBL7649914 0.79 IGF1R (0.47) MAPTTP53CYP3A4MAPK1MEN1
SCHEMBL7648451 0.77 TP53 (0.42) MAPTTP53MEN1KMT2ASMN1; SMN2
SCHEMBL7653470 0.77 LMNA (0.47) MAPTCYP3A4MAPK1MEN1KMT2A
SCHEMBL7648593 0.76 GPR183 (0.44) BAXMAPTTP53CYP3A4ALOX15
SCHEMBL157776 0.76 BAX (0.51) BAXMAPTTP53CYP3A4ALOX15
SCHEMBL7647940 0.75 SMN1; SMN2 (0.40) BAXMAPTTP53CYP3A4ALOX15
SCHEMBL7651244 0.75 SIGMAR1 (0.44) BAXMAPTTP53SMN1; SMN2
SCHEMBL7646726 0.75 LMNA (0.37) BAXMAPTTP53CYP3A4ALOX15

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