SCHEMBL30959359

SCHEMBL30959359

CC1(C)OB(C2(c3c(Br)cc4c(cnn4C4CCCCO4)c3Cl)CC2)OC1(C)C

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DGAT2 Q96PD7 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ CYP4F2 P78329 1/20 0.32
▸ CYP4A11 Q02928 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 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
SCHEMBL30959508 0.89 CYP4F2 (0.35) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL31527384 0.87 DGAT2 (0.35) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL20916885 0.82 RXRA (0.35) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL30959599 0.81 RXRA (0.39) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL30959476 0.81 RXRA (0.37) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL30959647 0.75 RXRA (0.40) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL23546535 0.74 RXRA (0.36) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL29734718 0.74 RXRA (0.38) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL26920565 0.74 RXRA (0.38) DGAT2RXRARXRBRXRGCYP4F2
SCHEMBL21243880 0.73 CYP4F2 (0.38) DGAT2RXRARXRBRXRGCYP4F2

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-4615847-A1 SMALL MOLECULE INHIBITORS OF KRAS PROTEINS Merck Sharp & Dohme LLC (US) 2025-09-17 — — EP disclosed
WO-2024103010-A1 SMALL MOLECULE INHIBITORS OF KRAS PROTEINS MERCK SHARP & DOHME LLC (US) 2024-05-16 — — WO disclosed
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