SCHEMBL21892129

SCHEMBL21892129

COC(=O)N1CC(C)N(c2ncc3[nH]nc(-c4ccc(N5CCN6CCCC6C5)cc4)c3n2)C(C)C1

nearest known ligand 0.81

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FGFR2 P21802 17/20 0.81
FGFR3 P22607 16/20 0.81
FGFR1 P11362 15/20 0.81
ACVR1 Q04771 13/20 0.80
BMPR1A P36894 5/20 0.76
TGFBR1 P36897 5/20 0.76
ACVRL1 P37023 5/20 0.76
HAMP P81172 4/20 0.76

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
SCHEMBL21846694 0.89 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21891935 0.89 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21846667 0.89 ACVR1 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL30434009 0.89 ACVR1 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21892128 0.89 ACVR1 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21846698 0.86 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL30433828 0.86 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21846736 0.86 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21815513 0.83 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A
SCHEMBL21846816 0.82 FGFR2 (1.00) FGFR2FGFR3FGFR1ACVR1BMPR1A

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
WO-2020068729-A1 PYRAZOLO[4,3-D]PYRIMIDINE COMPOUNDS AS ALK2 ABD/OR FGFR MODULATORS INCYTE CORPORATION (US) 2020-04-02 WO disclosed