SCHEMBL20836792

SCHEMBL20836792

COc1cc(OC)c(Cl)c(N(C(=O)OC(C)(C)C)C(=O)N(C)c2cc(N(C(=O)OC(C)(C)C)c3ccc(N4CCC5(CCN(C(=O)O)CC5)C4)cc3[N+](=O)[O-])ncn2)c1Cl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 12/20 0.38
▸ FGFR3 P22607 10/20 0.38
▸ FGFR4 P22455 10/20 0.38
▸ FGFR2 P21802 9/20 0.38
▸ CYP3A4 P08684 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ JAK2 O60674 1/20 0.31
▸ ABL1 P00519 1/20 0.31
▸ INSR P06213 1/20 0.31
▸ LCK P06239 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ YES1 P07947 1/20 0.31
▸ LYN P07948 1/20 0.31
▸ RET P07949 1/20 0.31
▸ MET P08581 1/20 0.31
▸ ROS1 P08922 1/20 0.31
▸ KIT P10721 1/20 0.31
▸ BCR P11274 1/20 0.31
▸ SRC P12931 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
SCHEMBL19633267 0.95 FGFR3 (0.38) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL30745795 0.95 FGFR3 (0.38) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL26802384 0.92 FGFR3 (0.37) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL19633418 0.90 FGFR1 (0.46) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL26802454 0.89 FGFR1 (0.46) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL20836813 0.88 FGFR1 (0.49) FGFR1FGFR3FGFR4FGFR2
SCHEMBL30745818 0.87 FGFR1 (0.45) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL19633419 0.87 FGFR1 (0.36) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL19633409 0.86 FGFR1 (0.42) FGFR1FGFR3FGFR4FGFR2CYP3A4
SCHEMBL19633322 0.86 FGFR1 (0.46) FGFR1FGFR3FGFR4FGFR2CYP3A4

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-3459952-A1 PYRIMIDINE DERIVATIVE, METHOD FOR PREPARING SAME AND USE THEREOF IN MEDICINE Zhejiang Hisun Pharmaceutical Co., Ltd. (CN) 2019-03-27 — — EP disclosed
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