SCHEMBL3826782

SCHEMBL3826782

CN(C(=O)c1ccccc1)c1ccncn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.57
▸ KMT2A Q03164 3/20 0.57
▸ GRM1 Q13255 2/20 0.48
▸ RAB9A P51151 3/20 0.45
▸ HSD17B10 Q99714 3/20 0.45
▸ SMN1; SMN2 Q16637 2/20 0.45
▸ TNKS O95271 1/20 0.42
▸ PARP1 P09874 1/20 0.42
▸ TNKS2 Q9H2K2 1/20 0.42
▸ LMNA P02545 2/20 0.42
▸ NPC1 O15118 2/20 0.42
▸ TP53 P04637 1/20 0.42
▸ CASP3 P42574 1/20 0.42
▸ SENP8 Q96LD8 1/20 0.42
▸ SENP7 Q9BQF6 1/20 0.42
▸ SENP6 Q9GZR1 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ HTT P42858 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ GFER P55789 1/20 0.40

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
SCHEMBL6316045 0.81 TSHR (0.58) KDM4EKMT2AGRM1RAB9AHSD17B10
SCHEMBL18765295 0.79 KDM4E (0.63) KDM4EKMT2AGRM1RAB9AHSD17B10
SCHEMBL13627914 0.78 P2RX7 (0.38) KDM4EKMT2AGRM1SMN1; SMN2TNKS
SCHEMBL29382234 0.76 P2RX7 (0.41) KDM4EKMT2AGRM1TNKSPARP1
SCHEMBL14507079 0.75 KMT2A (0.58) KDM4EKMT2AGRM1RAB9AHSD17B10
SCHEMBL10801846 0.73 KDM4E (1.00) KDM4EKMT2AGRM1RAB9AHSD17B10
SCHEMBL19095286 0.72 P2RX7 (0.41) KDM4EKMT2AGRM1
SCHEMBL5838645 0.72 HSD17B10 (0.60) KDM4ERAB9AHSD17B10NPC1TP53
SCHEMBL16656093 0.71 KDM4E (0.40) KDM4EKMT2ARAB9ASMN1; SMN2LMNA
SCHEMBL27965649 0.71 KDM4E (0.61) KDM4EKMT2ARAB9AHSD17B10SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099447-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS Incyte Corporation (US) 2009-09-16 — — EP disclosed
WO-2008064157-A1 IMIDAZOTRIAZINES AND IMIDAZOPYRIMIDINES AS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-05-29 — — WO disclosed
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