SCHEMBL11062596

SCHEMBL11062596

CN(C)c1nc(=O)c(-c2ccc(F)cc2)nn1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.40
▸ HSD17B10 Q99714 6/20 0.40
▸ CYP1A2 P05177 5/20 0.40
▸ CASP1 P29466 5/20 0.40
▸ CASP7 P55210 5/20 0.40
▸ GLA P06280 2/20 0.40
▸ LMNA P02545 1/20 0.39
▸ CSNK1E P49674 2/20 0.38
▸ ADORA2A P29274 2/20 0.38
▸ ADORA1 P30542 2/20 0.38
▸ MAPK14 Q16539 2/20 0.36
▸ HIF1A Q16665 4/20 0.36
▸ USP2 O75604 4/20 0.36
▸ CYP2C9 P11712 3/20 0.36
▸ CYP2D6 P10635 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ TSHR P16473 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ CYP3A4 P08684 1/20 0.36

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
SCHEMBL11062613 0.85 ALDH1A1 (0.40) ALDH1A1HSD17B10CYP1A2CASP1CASP7
SCHEMBL11074426 0.77 MAPK14 (0.44) ALDH1A1CSNK1EADORA2AADORA1MAPK14
SCHEMBL1786845 0.65 NPSR1 (0.56) ALDH1A1CYP1A2ADORA2AADORA1CYP2C9
SCHEMBL14067727 0.60 MAPK14 (0.47) ALDH1A1ADORA2AADORA1MAPK14
SCHEMBL28746869 0.60 MAPK14 (0.61) CSNK1EADORA2AADORA1MAPK14ADORA3
SCHEMBL1302241 0.59 KDM4E (0.39) GLAKMT2ACYP3A4
SCHEMBL11068704 0.58 MAPK14 (0.47) ALDH1A1MAPK14
SCHEMBL8502939 0.57 MEN1 (0.47) ADORA2AADORA1MAPK14MEN1KMT2A
SCHEMBL19992642 0.56 CYP1A2 (0.54) CYP1A2LMNAMAPK14CYP2D6MEN1
SCHEMBL10368512 0.55 ALDH1A1 (0.51) ALDH1A1HSD17B10CYP1A2CASP1CASP7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0044696-B1 5-OXO-2,5,-DIHYDRO-1,2,4-TRIAZINES, METHODS FOR THEIR PRODUCTION, HERBICIDAL COMPOSITIONS COMPRISING THEM, AND THEIR USE AS HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-10-17 — — EP disclosed
US-4451283-A HERBICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-05-29 — — US disclosed
EP-0044696-A2 5-Oxo-2,5,-dihydro-1,2,4-triazines, methods for their production, herbicidal compositions comprising them, and their use as herbicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-01-27 — — EP disclosed
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