SCHEMBL19101490

SCHEMBL19101490

CNC(=O)c1cc(CCc2cnc(Nc3ccc(N4C=C(C)N(C)[C@@H](C)C4)cc3)nc2)c(F)c(OC)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FGFR3 P22607 11/20 0.42
▸ KDR P35968 4/20 0.39
▸ KCNH2 Q12809 2/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ FGFR2 P21802 1/20 0.39
▸ FGFR4 P22455 1/20 0.39
▸ PTK2 Q05397 5/20 0.36
▸ LCK P06239 2/20 0.35
▸ MAPK14 Q16539 2/20 0.35
▸ ULK1 O75385 1/20 0.34
▸ JAK2 O60674 1/20 0.33
▸ NTRK1 P04629 1/20 0.33
▸ TYK2 P29597 1/20 0.33
▸ JAK3 P52333 1/20 0.33
▸ PTK2B Q14289 1/20 0.33
▸ NTRK3 Q16288 1/20 0.33
▸ NTRK2 Q16620 1/20 0.33
▸ ALK Q9UM73 1/20 0.33

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
SCHEMBL19101564 0.91 BRD4 (0.38) FGFR3KDRFGFR1PTK2LCK
SCHEMBL19101589 0.90 FGFR3 (0.40) FGFR3KDRKCNH2FGFR1FGFR2
SCHEMBL17470090 0.86 FGFR3 (0.46) FGFR3KDRKCNH2FGFR1FGFR2
SCHEMBL19101531 0.84 FGFR3 (0.41) FGFR3KDRKCNH2FGFR1FGFR2
SCHEMBL16053170 0.83 FGFR1 (0.48) FGFR3KDRKCNH2FGFR1FGFR2
SCHEMBL19101625 0.83 FGFR4 (0.39) FGFR3KDRFGFR1FGFR2FGFR4
SCHEMBL19101534 0.83 FGFR3 (0.37) FGFR3KDRKCNH2FGFR1FGFR4
SCHEMBL19101575 0.82 FGFR3 (0.41) FGFR3KDRKCNH2FGFR1FGFR2
SCHEMBL17470015 0.82 FGFR3 (0.43) FGFR3KDRKCNH2FGFR1FGFR2
SCHEMBL19101602 0.82 FGFR3 (0.47) FGFR3KCNH2FGFR1FGFR2FGFR4

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-9701680-B2 Pyrimidine and pyridine compounds and their usage HUTCHISON MEDIPHARMA LIMITED (CN) 2017-07-11 — — US disclosed
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