SCHEMBL28615670

SCHEMBL28615670

NC(=O)Oc1ccc(C=Cc2ncn(-c3ccc(OC(F)(F)F)cc3)n2)cc1Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 3/20 0.36
PPARA Q07869 3/20 0.36
PPARG P37231 1/20 0.36
MAPT P10636 2/20 0.36
MAPK1 P28482 1/20 0.36
RECQL P46063 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NOTUM Q6P988 1/20 0.34
MARS1 P56192 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
IP6K1 Q92551 1/20 0.32
IP6K3 Q96PC2 1/20 0.32
IP6K2 Q9UHH9 1/20 0.32
HSD17B13 Q7Z5P4 1/20 0.31
EGLN1 Q9GZT9 1/20 0.31
SCN9A Q15858 1/20 0.31
RXRA P19793 1/20 0.31
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 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
SCHEMBL28615666 1.00 PPARD (0.36) PPARDPPARAPPARGMAPTMAPK1
SCHEMBL28921756 0.87 PPARD (0.37) PPARDPPARAPPARGMAPTMAPK1
SCHEMBL28629677 0.86 CYP2D6 (0.36) SMN1; SMN2RXRAGRIN1GRIN2B
SCHEMBL18579390 0.83 MAPT (0.40) MAPTMAPK1RECQLL3MBTL1MARS1
SCHEMBL18579391 0.83 MAPT (0.40) MAPTMAPK1RECQLL3MBTL1MARS1
SCHEMBL28624281 0.82 HDAC1 (0.34) SCN9ARXRAGRIN1GRIN2B
SCHEMBL28624282 0.82 HDAC1 (0.34) SCN9ARXRAGRIN1GRIN2B
SCHEMBL28614901 0.82 SERPINE1 (0.35) PPARGMAPT
SCHEMBL18579719 0.81 POLB (0.41) NOTUMMARS1SMN1; SMN2HSD17B13
SCHEMBL18579720 0.81 POLB (0.41) NOTUMMARS1SMN1; SMN2HSD17B13

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
CN-108025189-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2021-07-02 CN disclosed