SCHEMBL25663373

SCHEMBL25663373

CNc1cc2c(Nc3cncc(-c4ccccc4F)c3)ncnc2cc1OCCCN1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 17/20 0.59
▸ ERBB2 P04626 5/20 0.57
▸ SRC P12931 7/20 0.57
▸ KDR P35968 5/20 0.57
▸ KIT P10721 3/20 0.57
▸ ERBB3 P21860 3/20 0.57
▸ ERBB4 Q15303 3/20 0.57
▸ LCK P06239 3/20 0.57
▸ RET P07949 3/20 0.57
▸ MET P08581 3/20 0.57
▸ LTK P29376 3/20 0.57
▸ MAP4K5 Q9Y4K4 3/20 0.57
▸ CIT O14578 2/20 0.57
▸ GAK O14976 2/20 0.57
▸ EPHB6 O15197 2/20 0.57
▸ RIPK2 O43353 2/20 0.57
▸ STK17B O94768 2/20 0.57
▸ STK10 O94804 2/20 0.57
▸ ABL1 P00519 2/20 0.57
▸ LYN P07948 2/20 0.57

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
SCHEMBL25247384 0.88 EGFR (0.73) EGFRERBB2SRCKDRKIT
SCHEMBL30549072 0.88 EGFR (0.73) EGFRERBB2SRCKDRKIT
SCHEMBL25663378 0.85 EGFR (0.53) EGFRERBB2KDRRETFLT4
SCHEMBL30549071 0.85 EGFR (0.67) EGFRERBB2SRCKDRKIT
SCHEMBL25250810 0.85 EGFR (0.67) EGFRERBB2SRCKDRKIT
SCHEMBL25662767 0.84 SRC (0.61) EGFRERBB2SRCKDRKIT
SCHEMBL25663172 0.83 SRC (0.60) EGFRERBB2SRCKDRKIT
SCHEMBL25663079 0.82 EGFR (0.58) EGFRERBB2SRCKDRKIT
SCHEMBL25663305 0.82 EGFR (0.61) EGFRERBB2KDRFLT4FLT1
SCHEMBL30429405 0.82 EGFR (0.69) EGFRERBB2SRCKDRKIT

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-4194443-A1 EFGR INHIBITOR, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF Abbisko Therapeutics Co., Ltd. (CN) 2023-06-14 — — EP disclosed
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