SCHEMBL30922452

SCHEMBL30922452

COC(=O)CCCCc1c(Cl)cc2c(cnn2C2CCCCO2)c1B1OC(C)(C)C(C)(C)O1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ RXRG P48443 1/20 0.35
▸ DGAT2 Q96PD7 1/20 0.33
▸ CYP4F2 P78329 1/20 0.31
▸ CYP4A11 Q02928 1/20 0.31

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
SCHEMBL30923128 0.94 RXRA (0.34) RXRARXRBRXRGDGAT2CYP4F2
SCHEMBL30758935 0.92 KRAS (0.34) RXRARXRBRXRGDGAT2
SCHEMBL30922645 0.92 RXRA (0.39) RXRARXRBRXRGDGAT2CYP4F2
SCHEMBL30922742 0.89 RXRA (0.35) RXRARXRBRXRGDGAT2CYP4F2
SCHEMBL30922886 0.87 RXRA (0.36) RXRARXRBRXRGDGAT2CYP4F2
SCHEMBL30922667 0.86 DGAT2 (0.33) RXRARXRBRXRGDGAT2
SCHEMBL30922553 0.85 KRAS (0.36) RXRARXRBRXRGDGAT2
SCHEMBL30922504 0.85 CYP4F2 (0.35) RXRARXRBRXRGCYP4F2CYP4A11
SCHEMBL30922623 0.85 RXRA (0.31) RXRARXRBRXRGDGAT2
SCHEMBL30922724 0.84 RXRA (0.38) RXRARXRBRXRGDGAT2CYP4F2

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
EP-4598921-A1 MACROCYCLIC KRAS INHIBITORS AND METHODS OF USE Amgen Inc. (US) 2025-08-13 — — EP disclosed
WO-2024107686-A1 MACROCYCLIC KRAS INHIBITORS AND METHODS OF USE AMGEN INC. (US) 2024-05-23 — — WO disclosed
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