SCHEMBL30864049

SCHEMBL30864049

O=C1CCN(c2cc(C(=O)N3CCC4(CCC(CCCO)CC4)CC3)ccc2Cl)C(=O)N1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 13/20 0.40
▸ AKR1C3 P42330 1/20 0.36
▸ DRD3 P35462 1/20 0.36
▸ MGLL Q99685 1/20 0.36
▸ SOS1 Q07889 2/20 0.35
▸ KMT2A Q03164 1/20 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
SCHEMBL27118484 0.95 FFAR4 (0.45) FFAR4AKR1C3DRD3MGLLSOS1
SCHEMBL29893498 0.95 FFAR4 (0.45) FFAR4AKR1C3DRD3MGLLSOS1
SCHEMBL30864092 0.91 FFAR4 (0.39) FFAR4DRD3MGLLSOS1
SCHEMBL27123389 0.90 FFAR4 (0.38) FFAR4DRD3SOS1KMT2A
SCHEMBL30014467 0.90 FFAR4 (0.38) FFAR4DRD3SOS1KMT2A
SCHEMBL30864018 0.89 FFAR4 (0.41) FFAR4DRD3MGLLSOS1
SCHEMBL30267230 0.87 HTT (0.39) FFAR4DRD3SOS1KMT2A
SCHEMBL29892407 0.87 DDB1 (0.40) FFAR4SOS1
SCHEMBL27121574 0.86 FFAR4 (0.40) FFAR4DRD3MGLLKMT2A
SCHEMBL30014595 0.86 GABRD (0.37) FFAR4SOS1

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-117917416-A KRAS G12D degradation agent and preparation method and application thereof 上海领泰生物医药科技有限公司 2024-04-23 — — CN disclosed
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