SCHEMBL11062613

SCHEMBL11062613

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

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.40
▸ CYP1A2 P05177 8/20 0.40
▸ USP2 O75604 6/20 0.40
▸ CASP1 P29466 6/20 0.40
▸ CASP7 P55210 6/20 0.40
▸ HIF1A Q16665 6/20 0.40
▸ HSD17B10 Q99714 5/20 0.40
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ MEN1 O00255 5/20 0.36
▸ KMT2A Q03164 5/20 0.36
▸ CYP2D6 P10635 4/20 0.36
▸ HPGD P15428 2/20 0.36
▸ MAPK1 P28482 2/20 0.36
▸ LMNA P02545 2/20 0.36
▸ GLA P06280 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ ADORA2A P29274 3/20 0.35
▸ ADORA1 P30542 3/20 0.35
▸ ADORA3 P0DMS8 2/20 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
SCHEMBL11062596 0.85 ALDH1A1 (0.40) ALDH1A1CYP1A2USP2CASP1CASP7
SCHEMBL11073774 0.77 ALDH1A1 (0.47) ALDH1A1HSD17B10KMT2AHPGDLMNA
SCHEMBL11218668 0.68 BRD4 (0.48) ALDH1A1CYP1A2CASP1CASP7HIF1A
SCHEMBL1789226 0.65 NPSR1 (0.64) ALDH1A1CYP1A2CYP2C9CYP2C19MEN1
SCHEMBL115647 0.64 LMNA (0.47) ALDH1A1CYP1A2USP2KMT2AMAPK1
SCHEMBL11074426 0.62 MAPK14 (0.44) ALDH1A1ADORA2AADORA1ADORA3L3MBTL1
SCHEMBL10611151 0.60 NR1H4 (0.46) ALDH1A1HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL14875789 0.60 GAA (0.50) ALDH1A1CYP1A2CASP1CASP7HSD17B10
SCHEMBL22997641 0.58 CYP1A2 (0.35) ALDH1A1CYP1A2USP2CASP1CASP7
SCHEMBL5892111 0.58 MAPT (0.45) ALDH1A1HSD17B10MEN1KMT2AMAPK1

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
Send feedback