SCHEMBL10967902

SCHEMBL10967902

O=C(O)c1cccnc1Oc1ccc(Cl)c(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 4/20 0.48
SCN5A Q14524 1/20 0.48
RAB9A P51151 1/20 0.48
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
GRM4 Q14833 1/20 0.44
KDR P35968 3/20 0.44
P2RY1 P47900 1/20 0.44
TDP1 Q9NUW8 1/20 0.43
MAPK8 P45983 1/20 0.43
RAF1 P04049 2/20 0.43
PDE10A Q9Y233 1/20 0.43

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
SCHEMBL7320114 0.84 RAB9A (0.55) RAB9ATDP1MAPK8PDE10A
SCHEMBL10972205 0.82 KMT2A (0.65) GRM4KDRP2RY1RAF1
SCHEMBL2336921 0.81 RAB9A (0.54) RAB9ATDP1MAPK8PDE10A
SCHEMBL2785360 0.80 TDP1 (0.54) RAB9ATDP1MAPK8PDE10A
SCHEMBL7368546 0.80 RAB9A (0.50) RAB9APPARGTDP1MAPK8PDE10A
SCHEMBL10975279 0.79 KMT2A (0.72) SCN9ASCN5AGRM4KDRP2RY1
SCHEMBL2783088 0.79 ALK (0.49) SCN9AP2RY1TDP1
SCHEMBL30166677 0.79 MEN1 (0.63) P2RY1TDP1
SCHEMBL29991644 0.79 MEN1 (0.63) P2RY1TDP1
SCHEMBL2333429 0.79 MEN1 (0.63) P2RY1TDP1

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
EP-0053011-B1 NEW HERBICIDAL NICOTINAMIDE DERIVATIVES MAY & BAKER LIMITED (GB) 1985-04-03 EP disclosed
EP-0053011-A1 New herbicidal nicotinamide derivatives MAY & BAKER LIMITED (GB) 1982-06-02 EP disclosed