SCHEMBL7520091

SCHEMBL7520091

OC(=Cc1ccccn1)c1c(Cl)cccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.51
RAB9A P51151 2/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
ATM Q13315 1/20 0.45
NFE2L2 Q16236 2/20 0.44
POLB P06746 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.40
MAOA P21397 1/20 0.40
KDM4E B2RXH2 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MAPT P10636 1/20 0.38
NR4A1 P22736 1/20 0.37
USP2 O75604 1/20 0.37
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 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
SCHEMBL7517901 0.83 TDP1 (0.51) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL7525729 0.82 TDP1 (0.47) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL7521932 0.76 TDP1 (0.71) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL14611861 0.76 TDP1 (0.71) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL7519789 0.74 TDP1 (0.46) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL7518895 0.74 TDP1 (0.46) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL10707006 0.73 KDM4E (0.58) RAB9AKMT2AMEN1NPC1ATM
SCHEMBL25415051 0.73 TDP1 (0.67) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL21742339 0.71 TDP1 (0.59) TDP1RAB9AKMT2AMEN1NPC1
SCHEMBL21742340 0.71 TDP1 (0.59) TDP1RAB9AKMT2AMEN1NPC1

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
EP-0937044-B1 CFTR CHANNEL ACTIVATOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME CENTRE NAT RECH SCIENT (FR) 2002-01-30 EP disclosed