SCHEMBL25144685

SCHEMBL25144685

C=Cc1cnc(Nc2cc(C3CC3)c(N3CCC(N4CCN(C)CC4)CC3)cc2OC)nc1Nc1ccc2nccnc2c1S(=O)(=O)C(C)C

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 15/20 0.56
▸ ALK Q9UM73 7/20 0.51
▸ INSR P06213 4/20 0.51
▸ IGF1R P08069 3/20 0.51
▸ BMPR1B O00238 2/20 0.51
▸ PLK4 O00444 2/20 0.51
▸ GAK O14976 2/20 0.51
▸ ERN1 O75460 2/20 0.51
▸ STK10 O94804 2/20 0.51
▸ ABL1 P00519 2/20 0.51
▸ LCK P06239 2/20 0.51
▸ FYN P06241 2/20 0.51
▸ FES P07332 2/20 0.51
▸ YES1 P07947 2/20 0.51
▸ HCK P08631 2/20 0.51
▸ ROS1 P08922 2/20 0.51
▸ FER P16591 2/20 0.51
▸ EPHA2 P29317 2/20 0.51
▸ LTK P29376 2/20 0.51
▸ FLT3 P36888 2/20 0.51

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
SCHEMBL25144599 0.92 EGFR (0.65) EGFRALKINSRIGF1RBMPR1B
SCHEMBL25144536 0.89 ALK (0.64) EGFRALKINSRIGF1RBMPR1B
SCHEMBL25791461 0.88 EGFR (0.56) EGFRALKINSRIGF1R
SCHEMBL25791867 0.88 EGFR (0.56) EGFRALKINSRIGF1R
SCHEMBL25144784 0.88 EGFR (0.56) EGFRALKINSRIGF1RMET
SCHEMBL25789078 0.87 EGFR (0.56) EGFRALKINSRIGF1R
SCHEMBL25789194 0.87 EGFR (0.72) EGFR
SCHEMBL25144597 0.87 EGFR (0.57) EGFRALKINSRIGF1R
SCHEMBL25144473 0.86 EGFR (0.57) EGFRALKINSRIGF1R
SCHEMBL25789063 0.86 EGFR (0.61) EGFRALKINSRIGF1R

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-4166553-A1 ALKENYL PYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Hongyun Biotech Co., Ltd. (CN) 2023-04-19 — — EP disclosed
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