SCHEMBL21557748

SCHEMBL21557748

C=CC(=O)Nc1cc(N)c(OC)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.41
▸ EGFR P00533 7/20 0.41
▸ ERBB3 P21860 1/20 0.41
▸ DUS2 Q9NX74 1/20 0.41
▸ FGFR4 P22455 3/20 0.40
▸ FGFR1 P11362 2/20 0.40
▸ MAPK3 P27361 2/20 0.40
▸ ITK Q08881 2/20 0.40
▸ FGFR2 P21802 1/20 0.39
▸ FGFR3 P22607 1/20 0.39
▸ BTK Q06187 2/20 0.39
▸ GAK O14976 1/20 0.39
▸ PSMB11 A5LHX3 1/20 0.38
▸ PSMA7 O14818 1/20 0.38
▸ PSMB1 P20618 1/20 0.38
▸ PSMA1 P25786 1/20 0.38
▸ PSMA2 P25787 1/20 0.38
▸ PSMA3 P25788 1/20 0.38
▸ PSMA4 P25789 1/20 0.38
▸ PSMB8 P28062 1/20 0.38

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
SCHEMBL28579321 0.87 MAPT (0.47) TGM2EGFRERBB3DUS2FGFR4
SCHEMBL15345353 0.84 TGM2 (0.44) TGM2EGFRERBB3DUS2MAPK3
SCHEMBL24429190 0.83 TGM2 (0.41) TGM2FGFR4FGFR1MAPK3FGFR2
SCHEMBL14225885 0.82 CA1 (0.44) MEN1MAPTHTTKMT2A
SCHEMBL15345350 0.81 TGM2 (0.42) TGM2FGFR4FGFR1FGFR2FGFR3
SCHEMBL19732109 0.77 EGFR (0.40) EGFRFGFR4FGFR1FGFR2FGFR3
SCHEMBL19221937 0.75 EGFR (0.49) EGFRFGFR4FGFR1KDR
SCHEMBL19089377 0.75 BRPF1 (0.47) EGFRFGFR1
SCHEMBL21558029 0.75 EGFR (0.37) TGM2EGFRFGFR4FGFR1FGFR2
SCHEMBL31348830 0.75 EGFR (0.53) EGFR

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
EP-2844642-B1 COMPOUNDS FOR INHIBITING CELL PROLIFERATION IN EGFR-DRIVEN CANCERS ARIAD PHARMA INC (US) 2019-11-13 — — EP disclosed
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