SCHEMBL7651093

SCHEMBL7651093

CC(O)C(N1CCNCC1)n1c2ccccc2c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
MAPT P10636 4/20 0.51
LMNA P02545 1/20 0.48
POLB P06746 1/20 0.46
ATM Q13315 1/20 0.46
SIGMAR1 Q99720 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.38
S100A4 P26447 1/20 0.38
ADRB1 P08588 1/20 0.37
SIRT6 Q8N6T7 1/20 0.37
HTR7 P34969 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
SCHEMBL7649539 0.84 RAD52 (0.46) MEN1KMT2A
SCHEMBL7647642 0.81 BAX (0.46) MEN1KMT2AMAPT
SCHEMBL7648011 0.81 MEN1 (0.43) MEN1KMT2AMAPTSIGMAR1
SCHEMBL7649884 0.80 TSPO (0.39) MEN1KMT2AHTR7
SCHEMBL7653388 0.78 RAD52 (0.39) MEN1KMT2A
SCHEMBL7649923 0.77 ALDH1A1 (0.49) MEN1KMT2AMAPTLMNA
SCHEMBL1149958 0.76 MEN1 (1.00) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL7646727 0.76 HTR1A (0.40) MEN1KMT2AMAPTLMNAHTR7
SCHEMBL608452 0.74 RAD52 (0.69) MEN1KMT2AMAPTLMNAPOLB
SCHEMBL157776 0.74 BAX (0.51) MEN1KMT2AMAPTLMNA

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