SCHEMBL30412014

SCHEMBL30412014

FC(F)(F)c1nc(Br)cc2c1OCCN2

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 2/20 0.39
▸ EGFR P00533 2/20 0.34
▸ DHFR P00374 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ GRM5 P41594 1/20 0.31

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
SCHEMBL17491542 0.72 AR (0.40) AREGFRALDH1A1GAAMAPT
SCHEMBL30413143 0.72 EGFR (0.37) AREGFR
SCHEMBL24568075 0.67 RET (0.33) GRM5
SCHEMBL13035938 0.66 ALDH1A1 (0.35) AREGFRALDH1A1GAAMAPT
SCHEMBL29620781 0.66 ALDH1A1 (0.35) AREGFRALDH1A1GAAMAPT
SCHEMBL24254608 0.66 ADRA2A (0.37) AREGFRALDH1A1GAAMAPT
SCHEMBL17077824 0.66 RET (0.32) DHFR
SCHEMBL382392 0.64 GRM5 (0.51) AREGFRALDH1A1GAAMAPT
SCHEMBL1812071 0.64 ALDH1A1 (0.33) DHFRALDH1A1GAAMAPTHSD17B10
SCHEMBL17799382 0.62 AR (0.53) AREGFRALDH1A1GAAMAPT

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-4182322-A1 PYRIDO OXAZINE DERIVATIVES AS ALK5 INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2023-05-24 — — EP disclosed
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