SCHEMBL28275870

SCHEMBL28275870

Fc1cc(-c2ccncc2)cc2cccnc12

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 6/20 0.66
▸ KDM4E B2RXH2 6/20 0.66
▸ NPC1 O15118 3/20 0.66
▸ RAB9A P51151 3/20 0.66
▸ MET P08581 1/20 0.46
▸ PDGFRB P09619 1/20 0.45
▸ PDGFRA P16234 1/20 0.45
▸ ADORA3 P0DMS8 1/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ ADORA1 P30542 1/20 0.43
▸ MAPK14 Q16539 3/20 0.42
▸ CCR1 P32246 3/20 0.41
▸ CCR8 P51685 3/20 0.41
▸ GMNN O75496 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ TP53 P04637 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ MMP2 P08253 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41

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
SCHEMBL3718956 0.83 KDM4E (0.46) L3MBTL1KDM4ENPC1RAB9AADORA3
SCHEMBL9275208 0.77 SLC40A1 (0.50) L3MBTL1KDM4ENPC1RAB9ACCR1
SCHEMBL25523414 0.74 KDM4E (0.51) L3MBTL1KDM4ENPC1RAB9AMET
SCHEMBL20600822 0.74 FEN1 (0.45) L3MBTL1KDM4ENPC1RAB9AMET
SCHEMBL25522331 0.73 L3MBTL1 (0.50) L3MBTL1KDM4ENPC1RAB9AMET
SCHEMBL3713624 0.73 PSMD14 (0.62) L3MBTL1KDM4ENPC1CCR1CCR8
SCHEMBL14242732 0.73 HSP90AA1 (0.54) L3MBTL1KDM4ENPC1RAB9ACCR1
SCHEMBL22271011 0.73 CCR1 (0.45) L3MBTL1KDM4ENPC1RAB9AADORA3
SCHEMBL1148265 0.73 CCR1 (0.50) L3MBTL1KDM4ECCR1CCR8GMNN
SCHEMBL1148955 0.73 CCR1 (0.45) L3MBTL1KDM4ENPC1RAB9AADORA3

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
CN-106132951-B quinoline-based kinase inhibitors 百时美施贵宝公司 2019-02-12 — — CN disclosed
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