SCHEMBL11250867

SCHEMBL11250867

O=C(NC(=O)c1ccccc1Cl)Nc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.63
NPC1 O15118 5/20 0.59
RAB9A P51151 5/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
NOX1 Q9Y5S8 2/20 0.56
GCGR P47871 1/20 0.56
LTA4H P09960 1/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
CA12 O43570 1/20 0.55
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
CA9 Q16790 1/20 0.55
GPR55 Q9Y2T6 1/20 0.53
PYGL P06737 1/20 0.53
ALDH1A1 P00352 2/20 0.52

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
SCHEMBL11385899 0.95 TDP1 (0.60) TDP1NPC1RAB9ASMN1; SMN2NOX1
SCHEMBL11243370 0.93 GCGR (0.62) TDP1NPC1RAB9ASMN1; SMN2NOX1
SCHEMBL11385942 0.93 GCGR (0.62) TDP1NPC1RAB9ASMN1; SMN2NOX1
SCHEMBL11235155 0.91 RAB9A (0.63) TDP1NPC1RAB9ASMN1; SMN2NOX1
SCHEMBL11242279 0.91 TDP1 (0.61) TDP1NPC1RAB9ASMN1; SMN2NOX1
SCHEMBL11236585 0.91 TDP1 (0.58) TDP1NPC1RAB9ASMN1; SMN2NOX1
SCHEMBL11228921 0.89 TDP1 (0.56) TDP1NPC1RAB9ASMN1; SMN2GCGR
SCHEMBL2371500 0.88 TDP1 (0.61) TDP1NPC1RAB9AGCGRLTA4H
SCHEMBL4627493 0.88 NPC1 (0.56) NPC1RAB9ASMN1; SMN2LTA4HMEN1
SCHEMBL11248869 0.88 TDP1 (0.64) TDP1NPC1RAB9ASMN1; SMN2GCGR

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-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 US disclosed