SCHEMBL26107396

SCHEMBL26107396

Cn1c(C2=CCC3(CC2)CCN(C(=O)OC(C)(C)C)CC3)c(-c2ccc(OC3CC3)nc2)c2c(N)ncnc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.41
▸ GPR119 Q8TDV5 3/20 0.41
▸ EGFR P00533 3/20 0.40
▸ TGFBR1 P36897 2/20 0.39
▸ PIK3CD O00329 5/20 0.38
▸ RET P07949 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ ABL1 P00519 2/20 0.38
▸ ABL2 P42684 2/20 0.38

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
SCHEMBL30582594 1.00 SRC (0.41) SRCGPR119EGFRTGFBR1PIK3CD
SCHEMBL30582600 0.91 SRC (0.44) SRCGPR119EGFRTGFBR1PIK3CD
SCHEMBL26104706 0.91 SRC (0.44) SRCGPR119EGFRTGFBR1PIK3CD
SCHEMBL31219355 0.89 SRC (0.42) SRCEGFRTGFBR1PIK3CDRET
SCHEMBL30582523 0.88 ITK (0.43) EGFR
SCHEMBL26104650 0.88 ITK (0.43) EGFR
SCHEMBL30582595 0.87 SRC (0.39) SRCGPR119EGFRTGFBR1PIK3CD
SCHEMBL26110909 0.87 SRC (0.39) SRCGPR119EGFRTGFBR1PIK3CD
SCHEMBL30582513 0.85 ITK (0.44) —
SCHEMBL30582525 0.85 ITK (0.44) —

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
WO-2024091370-A1 5,6-FUSED BICYCLIC HETEROAROMATIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2024-05-02 — — WO disclosed
WO-2023192502-A1 SPIROBICYCLIC COMPOUNDS ACERAND THERAPEUTICS (USA) LIMITED (US) 2023-10-05 — — WO disclosed
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