SCHEMBL9811544

SCHEMBL9811544

Clc1ccc(N(c2ccccc2)c2ccc3c(c2N(c2ccccc2)c2ccc(Cl)cc2)Cc2ccccc2-3)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.38
PNMT P11086 1/20 0.35
ACHE P22303 3/20 0.33
PGR P06401 1/20 0.33
CNR1 P21554 1/20 0.32
CYP1A2 P05177 2/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HSD17B10 Q99714 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
BCHE P06276 1/20 0.31
SRD5A2 P31213 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31

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
SCHEMBL9811549 0.91 PNMT (0.40) HSP90AA1PNMTACHEPGRCYP1A2
SCHEMBL9811551 0.80 PGR (0.36) HSP90AA1PNMTACHEPGRCYP1A2
SCHEMBL9811589 0.80 PNMT (0.35) HSP90AA1PNMTPGRCYP1A2CYP3A4
SCHEMBL16577737 0.77 PNMT (0.45) HSP90AA1PNMTACHEPGRCYP1A2
SCHEMBL28435765 0.76 PNMT (0.40) PNMTPGRCYP1A2CYP3A4CYP2D6
SCHEMBL30929930 0.76 PNMT (0.46) HSP90AA1PNMTACHEPGRCYP1A2
SCHEMBL1478410 0.76 PNMT (0.46) HSP90AA1PNMTACHEPGRCYP1A2
SCHEMBL20123179 0.75 CYP1A2 (0.42) HSP90AA1PNMTCNR1CYP1A2
SCHEMBL8070103 0.75 PNMT (0.39) HSP90AA1PNMTACHEPGRCYP1A2
SCHEMBL28416939 0.74 PNMT (0.45) HSP90AA1PNMTACHEPGRCYP1A2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5034296-A Photoconductive imaging members with fluorene polyester hole transporting layers XEROX CORPORATION (US) 1991-07-23 US claimed