SCHEMBL31398985

SCHEMBL31398985

CC(C)(C)OC(=O)N1CCC(N2Cc3c(Br)c4c(Cl)ncnc4n3CC2=O)C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.43
▸ EGFR P00533 3/20 0.43
▸ ABL1 P00519 2/20 0.41
▸ ABL2 P42684 2/20 0.41
▸ PIK3CD O00329 7/20 0.40
▸ USP30 Q70CQ3 2/20 0.39
▸ TP53 P04637 1/20 0.36
▸ FPR2 P25090 1/20 0.36
▸ NR3C1 P04150 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ TNF P01375 2/20 0.35
▸ LITAF Q99732 2/20 0.35

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
SCHEMBL31399002 0.90 SRC (0.53) SRCEGFRABL1ABL2PIK3CD
SCHEMBL31398956 0.81 SRC (0.42) SRCEGFRABL1ABL2PIK3CD
SCHEMBL31398952 0.79 POLB (0.42) SRCEGFRPIK3CD
SCHEMBL31398872 0.76 SRC (0.54) SRCEGFRABL1ABL2PIK3CD
SCHEMBL31398881 0.76 SRC (0.54) SRCEGFRABL1ABL2PIK3CD
SCHEMBL31398996 0.74 SRC (0.50) SRCEGFRABL1ABL2PIK3CD
SCHEMBL19731353 0.73 SRC (0.60) SRCEGFRABL1ABL2PIK3CD
SCHEMBL1442313 0.72 SRC (0.59) SRCEGFRABL1ABL2PIK3CD
SCHEMBL29588435 0.72 SRC (0.59) SRCEGFRABL1ABL2PIK3CD
SCHEMBL15345425 0.72 SRC (0.59) SRCEGFRABL1ABL2PIK3CD

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
CN-119176813-A Tricyclic heterocyclic compound with FGFR inhibition effect, pharmaceutical composition containing tricyclic heterocyclic compound and application of pharmaceutical composition 上海科恩泰生物医药科技有限公司 2024-12-24 — — CN disclosed
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