SCHEMBL7653433

SCHEMBL7653433

CC(=O)C(N1CCN(CC2CCCCC2)CC1)n1c2ccc(Br)cc2c2cc(Br)ccc21

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.44
CCR1 P32246 1/20 0.42
THRB P10828 3/20 0.40
MCHR1 Q99705 1/20 0.40
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
MAPK8 P45983 2/20 0.38
MEN1 O00255 1/20 0.38
RAD52 P43351 1/20 0.38
KMT2A Q03164 1/20 0.38
HTR7 P34969 1/20 0.38
TACR1 P25103 1/20 0.37
KDM2B Q8NHM5 2/20 0.36

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
SCHEMBL7648396 0.76 BAX (0.47) MAPT
SCHEMBL608957 0.76 CCR1 (0.47) CNR1CCR1THRBMAPTLMNA
SCHEMBL607458 0.76 RAD52 (0.66) MAPTLMNAMEN1RAD52KMT2A
SCHEMBL607028 0.72 MEN1 (0.76) MAPTLMNAMEN1RAD52KMT2A
SCHEMBL608135 0.71 RAD52 (0.48) CNR1CCR1MAPTLMNAMEN1
SCHEMBL6363590 0.69 MAPT (0.61) CNR1MAPTLMNAMAPK8MEN1
SCHEMBL7652515 0.66 MAPT (0.53) MAPTLMNAMEN1RAD52KMT2A
SCHEMBL1696714 0.64 CNR2 (0.41) CNR1MAPTLMNAMEN1RAD52
SCHEMBL22439063 0.63 ICMT (0.48) CNR1MAPK8
SCHEMBL22439157 0.62 ICMT (0.48) CNR1MAPK8

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