SCHEMBL28542484

SCHEMBL28542484

CCc1cc(Nc2ncnc(Nc3ccc4nccnc4c3P(C)C)n2)c(OC)cc1N1CCC(N2CCN(C)CC2)CC1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 19/20 0.66
▸ FGFR1 P11362 1/20 0.49
▸ FGFR2 P21802 1/20 0.49
▸ FGFR4 P22455 1/20 0.49
▸ FGFR3 P22607 1/20 0.49
▸ KDR P35968 1/20 0.49
▸ BMPR1B O00238 1/20 0.47
▸ PLK4 O00444 1/20 0.47
▸ GAK O14976 1/20 0.47
▸ ERN1 O75460 1/20 0.47
▸ STK10 O94804 1/20 0.47
▸ ABL1 P00519 1/20 0.47
▸ INSR P06213 1/20 0.47
▸ LCK P06239 1/20 0.47
▸ FYN P06241 1/20 0.47
▸ NPM1 P06748 1/20 0.47
▸ FES P07332 1/20 0.47
▸ YES1 P07947 1/20 0.47
▸ IGF1R P08069 1/20 0.47
▸ HCK P08631 1/20 0.47

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
SCHEMBL30626523 0.95 EGFR (0.59) EGFRFGFR1FGFR2FGFR4FGFR3
SCHEMBL28531358 0.95 EGFR (0.59) EGFRFGFR1FGFR2FGFR4FGFR3
SCHEMBL28538542 0.94 EGFR (0.59) EGFR
SCHEMBL28542534 0.93 EGFR (0.56) EGFRFGFR1FGFR2FGFR4FGFR3
SCHEMBL28537031 0.92 EGFR (0.56) EGFRFGFR1FGFR2FGFR4FGFR3
SCHEMBL28535440 0.92 EGFR (0.56) EGFR
SCHEMBL22804355 0.92 EGFR (0.59) EGFRFGFR1FGFR2FGFR4FGFR3
SCHEMBL28527856 0.91 EGFR (0.60) EGFRFGFR1FGFR2FGFR4FGFR3
SCHEMBL25144770 0.90 EGFR (0.69) EGFR
SCHEMBL22025902 0.90 EGFR (0.81) 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
CN-112513029-A Nitrogen-containing aryl phosphorus oxide derivative, preparation method and application thereof 上海翰森生物医药科技有限公司 2021-03-16 — — CN disclosed
Send feedback