SCHEMBL26147980

SCHEMBL26147980

CN(C)C1CCN(CCn2nc(-c3ncc(NC(=O)OC(C)(C)C)c4c3OCO4)c3c(N)ncnc32)CC1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 15/20 0.69
▸ PTK6 Q13882 12/20 0.69
▸ FYN P06241 10/20 0.69
▸ HCK P08631 7/20 0.69
▸ BLK P51451 7/20 0.69
▸ LYN P07948 7/20 0.69
▸ FRK P42685 7/20 0.69
▸ LCK P06239 6/20 0.69
▸ ABL1 P00519 15/20 0.68
▸ YES1 P07947 7/20 0.55
▸ FGR P09769 7/20 0.55
▸ RET P07949 4/20 0.51
▸ KIT P10721 1/20 0.47
▸ MTOR P42345 1/20 0.41

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
SCHEMBL26147920 0.90 PTK6 (0.71) SRCPTK6FYNHCKBLK
SCHEMBL26147978 0.88 ABL1 (0.67) SRCPTK6FYNHCKBLK
SCHEMBL26147979 0.87 SRC (0.68) SRCPTK6FYNHCKBLK
SCHEMBL26148018 0.85 ABL1 (0.66) SRCPTK6FYNHCKBLK
SCHEMBL26148019 0.85 ABL1 (0.66) SRCPTK6FYNHCKBLK
SCHEMBL26148066 0.85 ABL1 (0.66) SRCPTK6FYNHCKBLK
SCHEMBL26148013 0.85 ABL1 (0.66) SRCPTK6FYNHCKBLK
SCHEMBL26147976 0.84 SRC (0.66) SRCPTK6FYNHCKBLK
SCHEMBL18258333 0.82 SRC (1.00) SRCPTK6FYNHCKBLK
SCHEMBL26148021 0.81 ABL1 (0.72) SRCPTK6FYNHCKBLK

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
WO-2023083373-A1 COMPOUND USED AS SRC INHIBITOR 微境生物医药科技(上海)有限公司 2023-05-19 — — WO disclosed
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