SCHEMBL30959508

SCHEMBL30959508

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

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 2/20 0.35
▸ CYP4A11 Q02928 2/20 0.35
▸ DGAT2 Q96PD7 1/20 0.33
▸ RXRA P19793 1/20 0.33
▸ RXRB P28702 1/20 0.33
▸ RXRG P48443 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ YTHDC1 Q96MU7 1/20 0.30

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
SCHEMBL30959359 0.89 DGAT2 (0.33) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL31527384 0.83 DGAT2 (0.35) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL20916885 0.82 RXRA (0.35) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL30959155 0.82 CYP4F2 (0.40) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL30959489 0.81 CYP4F2 (0.41) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL24803541 0.81 CYP4F2 (0.37) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL29937228 0.81 CYP4F2 (0.37) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL29168262 0.77 CYP4F2 (0.39) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL21379111 0.75 CYP4F2 (0.40) CYP4F2CYP4A11DGAT2RXRARXRB
SCHEMBL29592576 0.75 CYP4F2 (0.40) CYP4F2CYP4A11DGAT2RXRARXRB

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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