SCHEMBL26148542

SCHEMBL26148542

CN(C1CC1)C1CCN(CCn2nc(I)c3c(N)ncnc32)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 16/20 0.58
▸ FYN P06241 12/20 0.58
▸ ABL1 P00519 11/20 0.58
▸ YES1 P07947 9/20 0.58
▸ FGR P09769 9/20 0.58
▸ LYN P07948 8/20 0.58
▸ FRK P42685 7/20 0.58
▸ LCK P06239 7/20 0.58
▸ RET P07949 5/20 0.58
▸ BLK P51451 8/20 0.50
▸ PTK6 Q13882 9/20 0.48
▸ HCK P08631 7/20 0.48
▸ KIT P10721 1/20 0.47
▸ CDC7 O00311 1/20 0.45
▸ PLK4 O00444 1/20 0.45
▸ DYRK3 O43781 1/20 0.45
▸ JAK2 O60674 1/20 0.45
▸ PRKD3 O94806 1/20 0.45
▸ MAP4K4 O95819 1/20 0.45
▸ NTRK1 P04629 1/20 0.45

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
SCHEMBL18250080 0.92 SRC (0.68) SRCFYNABL1YES1FGR
SCHEMBL18258360 0.86 SRC (0.69) SRCFYNABL1YES1FGR
SCHEMBL18258364 0.83 ABL1 (0.51) SRCFYNABL1YES1FGR
SCHEMBL25030582 0.83 SRC (0.49) SRCFYNABL1YES1FGR
SCHEMBL18258356 0.82 SRC (0.64) SRCFYNABL1YES1FGR
SCHEMBL18250081 0.82 SRC (0.53) SRCFYNABL1YES1FGR
SCHEMBL25030580 0.82 SRC (0.59) SRCFYNABL1YES1FGR
SCHEMBL18258367 0.81 ABL1 (0.49) SRCFYNABL1YES1FGR
SCHEMBL26148254 0.81 SRC (0.74) SRCFYNABL1YES1FGR
SCHEMBL25033277 0.81 SRC (0.47) SRCFYNABL1YES1FGR

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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