SCHEMBL30363553

SCHEMBL30363553

CC(C)(C)OC(=O)NCCCCn1nc(-c2cc3ccc(OCc4ccccc4)cc3[nH]2)c2c(N)ncnc21

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ RET P07949 13/20 0.49
▸ KDR P35968 11/20 0.46
▸ FGFR1 P11362 1/20 0.46
▸ FGFR2 P21802 1/20 0.46
▸ SRC P12931 4/20 0.43
▸ HCK P08631 1/20 0.43
▸ ABL1 P00519 1/20 0.42
▸ BTK Q06187 1/20 0.42

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
SCHEMBL21528023 1.00 RET (0.49) RETKDRFGFR1FGFR2SRC
SCHEMBL30405204 0.90 RET (0.51) RETKDRFGFR1FGFR2SRC
SCHEMBL29669709 0.89 RET (0.55) RETKDRFGFR1FGFR2SRC
SCHEMBL23157800 0.89 RET (0.55) RETKDRFGFR1FGFR2SRC
SCHEMBL29939196 0.84 RET (0.48) RETKDRFGFR1FGFR2SRC
SCHEMBL19294573 0.84 RET (0.48) RETKDRFGFR1FGFR2SRC
SCHEMBL23150479 0.84 FGFR1 (0.45) RETKDRFGFR1FGFR2SRC
SCHEMBL23158015 0.84 RET (0.53) RETKDRFGFR1FGFR2SRC
SCHEMBL29669798 0.84 RET (0.53) RETKDRFGFR1FGFR2SRC
SCHEMBL20553605 0.84 FGFR1 (0.45) RETKDRFGFR1FGFR2SRC

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4168002-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS Revolution Medicines, Inc. (US) 2023-04-26 — — EP disclosed
EP-3788049-B1 C40-, C28-, AND C-32-LINKED RAPAMYCIN ANALOGS AS MTOR INHIBITORS REVOLUTION MEDICINES INC (US) 2023-03-29 — — EP disclosed
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