SCHEMBL26105835

SCHEMBL26105835

Cn1c(C2=CCC3(CC2)CCN(C(=O)OC(C)(C)C)CC3)c(-c2ncc(C3CCOC3)cn2)c2c(N)ncnc21

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.37
▸ EGFR P00533 3/20 0.37
▸ PIK3R1 P27986 6/20 0.35
▸ PIK3CA P42336 6/20 0.35
▸ RET P07949 2/20 0.35
▸ KDR P35968 2/20 0.35
▸ ABL1 P00519 2/20 0.35
▸ ABL2 P42684 2/20 0.35
▸ TGFBR1 P36897 1/20 0.34
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ MAP4K4 O95819 1/20 0.33
▸ HPGDS O60760 1/20 0.33

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
SCHEMBL30582632 1.00 SRC (0.37) SRCEGFRPIK3R1PIK3CARET
SCHEMBL31219425 0.92 SRC (0.40) SRCEGFRRETKDRABL1
SCHEMBL26134375 0.87 NUDT14 (0.37) EGFR
SCHEMBL30582534 0.87 NUDT14 (0.37) EGFR
SCHEMBL30582595 0.87 SRC (0.39) SRCEGFRRETKDRABL1
SCHEMBL26110909 0.87 SRC (0.39) SRCEGFRRETKDRABL1
SCHEMBL30582562 0.86 SRC (0.40) SRCEGFRRETKDRABL1
SCHEMBL26109440 0.86 SRC (0.40) SRCEGFRRETKDRABL1
SCHEMBL30582567 0.86 SRC (0.36) SRCEGFRRETKDRABL1
SCHEMBL30582563 0.86 SRC (0.36) SRCEGFRRETKDRABL1

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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