SCHEMBL16601622

SCHEMBL16601622

CNc1cccc(-c2cnc3c(c2)C(=O)C(=O)c2cc(C)cnc2-3)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.48
NTRK1 P04629 1/20 0.44
BRD4 O60885 1/20 0.39
FYN P06241 2/20 0.38
USP7 Q93009 1/20 0.38
TGFBR1 P36897 1/20 0.38
ACVR1 Q04771 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 1/20 0.38
MAPT P10636 2/20 0.37
CHEK2 O96017 1/20 0.37
CHEK1 O14757 1/20 0.36
FGFR1 P11362 1/20 0.36
NEK2 P51955 1/20 0.36
MAPK15 Q8TD08 1/20 0.36
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
RIPK1 Q13546 1/20 0.35
PLK4 O00444 1/20 0.35
PLCG1 P19174 1/20 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
SCHEMBL16601620 0.78 CDK8 (0.54) KMT2AFYNALDH1A1
SCHEMBL16656189 0.77 KMT2A (0.54) KMT2AFYNPTGS1PTGS2MAP4K4
SCHEMBL12108751 0.74 KMT2A (0.66) KMT2AUSP7PTGS1PTGS2PLCG1
SCHEMBL12556925 0.71 NPC1 (0.50) KMT2ANTRK1USP7MAPTCHEK2
SCHEMBL16601738 0.71 MAP4K4 (0.56) NTRK1FYNMAP4K4NPC1RAB9A
SCHEMBL13151876 0.71 KMT2A (0.71) KMT2AUSP7PTGS1PTGS2MAPT
SCHEMBL16601623 0.69 TDP2 (0.66) KMT2APTGS1PTGS2PLCG1TDP2
SCHEMBL16601621 0.68 KMT2A (0.44) KMT2AFYNPTGS1PTGS2CHEK2
SCHEMBL16602016 0.68 MAP4K4 (0.56) NTRK1FYNCHEK2CHEK1FGFR1
SCHEMBL24709106 0.68 CNR1 (0.50) NTRK1BRD4MAPTNPC1RAB9A

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
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed
US-8993205-B2 Electrophotographic photosensitive member, process cartridge, and electrophotographic apparatus CANON KABUSHIKI KAISHA (JP) 2015-03-31 US disclosed