SCHEMBL7652228

SCHEMBL7652228

CC(O)C(N1CCN(Cc2ccccn2)CC1)n1c2ccccc2c2cc(Br)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
RAD52 P43351 1/20 0.44
HRH1 P35367 2/20 0.41
HTR6 P50406 1/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 1/20 0.41
CNR2 P34972 1/20 0.41
ALDH1A1 P00352 8/20 0.39
KDM4E B2RXH2 6/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MAPK1 P28482 2/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
OPRD1 P41143 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C19 P33261 1/20 0.37

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
SCHEMBL7650324 0.86 MAPT (0.47) KMT2AMEN1RAD52MAPTTP53
SCHEMBL7647672 0.85 MEN1 (0.42) KMT2AMEN1RAD52MAPTTP53
SCHEMBL7653796 0.82 MAPT (0.50) KMT2AMEN1RAD52MAPTTP53
SCHEMBL7649585 0.82 MAPT (0.47) KMT2AMEN1RAD52MAPTTP53
SCHEMBL7649914 0.82 IGF1R (0.47) KMT2AMEN1RAD52MAPTTP53
SCHEMBL608163 0.82 MEN1 (0.68) KMT2AMEN1RAD52MAPTTP53
SCHEMBL7647493 0.82 MAPT (0.49) KMT2AMEN1RAD52HRH1MAPT
SCHEMBL7651313 0.82 KMT2A (0.44) KMT2AMEN1RAD52MAPTTP53
SCHEMBL7649502 0.81 MEN1 (0.47) KMT2AMEN1RAD52HTR6MAPT
SCHEMBL7654933 0.81 MAPT (0.51) KMT2AMEN1RAD52MAPTTP53

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 disclosed
WO-2001029028-A1 9- (PIPERAZINYLALKYL) CARBAZOLES AS BAX-MODULATORS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-04-26 WO disclosed