SCHEMBL10410879

SCHEMBL10410879

COc1cccc(Nc2ncncn2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 4/20 0.60
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ MAPT P10636 1/20 0.58
▸ MAPK1 P28482 1/20 0.58
▸ NPC1 O15118 4/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ KCNH3 Q9ULD8 1/20 0.56
▸ SYK P43405 1/20 0.56
▸ ERBB3 P21860 2/20 0.55
▸ PIK3CG P48736 3/20 0.55
▸ PIK3CA P42336 2/20 0.55
▸ PIK3CB P42338 2/20 0.55
▸ POLB P06746 1/20 0.54
▸ KDR P35968 2/20 0.54
▸ DYRK3 O43781 1/20 0.54
▸ MAP4K4 O95819 1/20 0.54
▸ PDGFRA P16234 1/20 0.54
▸ LTK P29376 1/20 0.54
▸ GRK5 P34947 1/20 0.54

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
SCHEMBL2284267 0.86 EGFR (0.72) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL10411688 0.84 SYK (0.58) EGFRMEN1KMT2AMAPTSYK
SCHEMBL22191547 0.81 SYK (0.60) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL29622027 0.80 ROCK1 (0.63) EGFRMEN1KMT2AMAPTNPC1
SCHEMBL1085867 0.80 MEN1 (0.71) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL28736394 0.78 EGFR (0.58) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL4544861 0.78 KCNH3 (0.70) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL4544834 0.78 KCNH3 (0.70) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL13302353 0.78 MEN1 (0.69) EGFRMEN1KMT2AMAPTMAPK1
SCHEMBL10412682 0.77 NFKB1 (0.57) EGFRMAPK1KCNH3SYKPIK3CG

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
US-4939243-A Water-soluble copper complex disazo compounds containg a chloro triazinylamino group and a group of the vinylsulfone series as fiber-reactive groups and their dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1990-07-03 — — US disclosed
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