SCHEMBL4493274

SCHEMBL4493274

CC(C)c1cc2c(c(-c3ccc(F)cc3)c1C(O)c1ccc(C(C)(C)C)cc1)[C@@H](O)CC(C)(C)O2

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CETP P11597 5/20 0.39
GCGR P47871 1/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
AKR1C3 P42330 1/20 0.31
AKR1C2 P52895 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
SCHEMBL4511582 1.00 CETP (0.39) CETPGCGRCNR1CNR2AKR1C3
SCHEMBL4493270 1.00 CETP (0.39) CETPGCGRCNR1CNR2AKR1C3
SCHEMBL4493423 0.93 CETP (0.46) CETPGCGRCNR1CNR2AKR1C3
SCHEMBL4493429 0.93 CETP (0.46) CETPGCGRCNR1CNR2AKR1C3
SCHEMBL4508331 0.93 CETP (0.46) CETPGCGRCNR1CNR2AKR1C3
SCHEMBL4511585 0.89 CETP (0.42) CETPGCGRAKR1C3AKR1C2
SCHEMBL4511591 0.89 CETP (0.42) CETPGCGRAKR1C3AKR1C2
SCHEMBL4514631 0.89 CETP (0.42) CETPGCGRAKR1C3AKR1C2
SCHEMBL27762199 0.88 CETP (0.32) CETPGCGRCNR1CNR2
SCHEMBL4517595 0.87 CETP (0.36) CETPGCGR

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
US-8227511-B2 Substituted chromanol derivatives and their use BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-07-24 US disclosed
US-20090306197-A1 Substituted Chromanol Derivatives and Their Use BAYER HEALTHCARE AG (DE) 2009-12-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090306197-A1 Substituted Chromanol Derivatives and Their Use CYP46A1, CBX3, CDYL CETP 108/4885GCGR 215/4885CNR1 657/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.