SCHEMBL7649596

SCHEMBL7649596

CC(O)C(N1CCN(Cc2ccc(F)cc2)CC1)n1c2ccccc2c2cc(-c3ccc(OC(F)(F)F)cc3)ccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
TSHR P16473 1/20 0.42
LMNA P02545 2/20 0.42
MAPK1 P28482 2/20 0.42
HTT P42858 2/20 0.42
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
SERPINE1 P05121 3/20 0.40
TP53 P04637 1/20 0.40
THRB P10828 1/20 0.40
CHRM2 P08172 2/20 0.39
CHRM1 P11229 2/20 0.39
CHRM5 P08912 1/20 0.39
CHRM3 P20309 1/20 0.39
PPARG P37231 1/20 0.39
MC4R P32245 1/20 0.38
CACNA1G O43497 4/20 0.37
KCNH2 Q12809 3/20 0.37
DRD2 P14416 1/20 0.37
DRD4 P21917 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
SCHEMBL7650378 0.90 MEN1 (0.43) LMNAMAPK1HTTMAPTSMN1; SMN2
SCHEMBL7650388 0.89 CHKA (0.41) MAPTSMN1; SMN2TP53MEN1KMT2A
SCHEMBL607069 0.84 LMNA (0.60) ALDH1A1LMNAMAPK1HTTMAPT
SCHEMBL7649894 0.84 MEN1 (0.49) LMNAMAPK1HTTMAPTSMN1; SMN2
SCHEMBL7653796 0.81 MAPT (0.50) LMNAMAPK1HTTMAPTSMN1; SMN2
SCHEMBL7653466 0.78 LMNA (0.65) ALDH1A1TSHRLMNAMAPK1HTT
SCHEMBL7648451 0.76 TP53 (0.42) ALDH1A1MAPTSMN1; SMN2TP53CACNA1G
SCHEMBL7652383 0.76 LMNA (0.50) LMNAMAPK1HTTMAPTSMN1; SMN2
SCHEMBL7646684 0.76 MAPT (0.48) ALDH1A1LMNAMAPK1HTTMAPT
SCHEMBL7649700 0.75 LMNA (0.59) ALDH1A1LMNAMAPK1HTTMAPT

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