SCHEMBL11462189

SCHEMBL11462189

Clc1ccc(-c2nc(-c3ccccc3)c(-c3ccc(Cl)cc3)s2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
CYP1A2 P05177 4/20 0.58
PTGDR2 Q9Y5Y4 3/20 0.58
ALDH1A1 P00352 3/20 0.58
CYP2C19 P33261 3/20 0.58
CYP2C9 P11712 2/20 0.58
HPGD P15428 1/20 0.58
PTGS2 P35354 3/20 0.57
GAA P10253 2/20 0.53
LMNA P02545 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CYP2D6 P10635 2/20 0.51
MAPT P10636 2/20 0.51
ALOX5 P09917 2/20 0.50
CYP3A4 P08684 1/20 0.50
APEX1 P27695 1/20 0.50
CYP1A1 P04798 1/20 0.50
CYP1B1 Q16678 1/20 0.50
FABP4 P15090 1/20 0.49
MEN1 O00255 1/20 0.49

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
SCHEMBL11284205 1.00 KDM4E (0.58) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL11460695 1.00 KDM4E (0.58) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL15689214 0.92 KDM4E (0.52) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL9768642 0.89 ALDH1A1 (0.62) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL15689086 0.86 PTGS2 (0.67) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL11463625 0.85 MAPK14 (0.53) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL11752931 0.84 KDM4E (0.55) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL21670773 0.84 PTGS2 (0.56) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL11755296 0.84 KDM4E (0.55) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19
SCHEMBL27690448 0.84 PTGS2 (0.55) KDM4ECYP1A2PTGDR2ALDH1A1CYP2C19

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
US-4197306-A CONTROL OF INSECTS AND ACARIDS UNIROYAL, INC. (US) 1980-04-08 US disclosed
US-4153703-A Method of controlling insects and acarids with certain aryl-substituted thiazoles UNIROYAL, INC. (US) 1979-05-08 US disclosed