SCHEMBL11236840

SCHEMBL11236840

Cc1cc(NC(=O)NC(=O)c2ccccc2Cl)ccc1OCc1ccc(C(F)(F)F)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 3/20 0.50
TDP1 Q9NUW8 1/20 0.50
GCGR P47871 1/20 0.49
NPSR1 Q6W5P4 1/20 0.48
S1PR1 P21453 1/20 0.48
GAA P10253 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
RAB9A P51151 1/20 0.47
PYGL P06737 1/20 0.46
MRGPRX4 Q96LA9 4/20 0.46
PPIA P62937 1/20 0.46
PLCG2 P16885 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
PCTP Q9UKL6 1/20 0.44
ALOX5 P09917 1/20 0.44
EPHX2 P34913 1/20 0.44

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
SCHEMBL11244138 0.89 GCGR (0.61) TDP1GCGRNPC1POLBPKM
SCHEMBL11251747 0.89 GCGR (0.55) TDP1GCGRNPC1POLBPKM
SCHEMBL11242062 0.89 TDP1 (0.67) TDP1GCGRNPSR1S1PR1NPC1
SCHEMBL11248869 0.84 TDP1 (0.64) TDP1GCGRNPSR1NPC1RAB9A
SCHEMBL11303176 0.84 GCGR (0.59) TDP1GCGRNPSR1S1PR1GAA
SCHEMBL11383033 0.83 MEN1 (0.53) TDP1GCGRGAANPC1POLB
SCHEMBL11240737 0.83 S1PR1 (0.59) LRRK2TDP1GCGRNPSR1S1PR1
SCHEMBL11239199 0.83 LRRK2 (0.50) LRRK2TDP1GAANPC1RAB9A
SCHEMBL11242220 0.83 S1PR1 (0.61) LRRK2TDP1GCGRNPSR1S1PR1
SCHEMBL11233013 0.82 PNLIP (0.53) TDP1GCGRNPSR1NPC1POLB

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