SCHEMBL8745904

SCHEMBL8745904

CCNC(=O)OC(c1ccccc1C(F)(F)F)c1cncn1C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.37
CNR2 P34972 1/20 0.37
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP24A1 Q07973 1/20 0.36
PLK1 P53350 1/20 0.36
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL8745954 0.81 KDM4E (0.39) CNR2KDM4EKMT2AHPGDSMN1; SMN2
SCHEMBL8745946 0.78 KDM4E (0.39) CNR2KDM4EKMT2ANPSR1SMN1; SMN2
SCHEMBL9028568 0.77 SCN9A (0.37) CNR2KDM4EKMT2A
SCHEMBL8745915 0.77 CYP3A4 (0.39) CNR2KDM4EKMT2AHPGDSMN1; SMN2
SCHEMBL8745950 0.76 CYP3A4 (0.39) CNR2KDM4EKMT2AHPGDSMN1; SMN2
SCHEMBL8328825 0.74 SSTR4 (0.38) KDM4EKMT2ANPSR1
SCHEMBL8745905 0.73 RBP4 (0.40) RBP4CNR2KMT2APLK1
SCHEMBL9028891 0.69 LIMK1 (0.37) CNR2KDM4EKMT2A
SCHEMBL10217349 0.68 CNR2 (0.41) CNR2KDM4EKMT2AHPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL3448575 0.67 POLB (0.40) CNR2KDM4EKMT2AHPGDSMN1; SMN2

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-0758323-A1 HERBICIDAL HYDROXYBENZYL-SUBSTITUTED HETEROARYL COMPOUNDS AND DERIVATIVES THEREOF ZENECA LIMITED (GB) 1997-02-19 EP disclosed