SCHEMBL6863331

SCHEMBL6863331

CCOC(=O)C(=O)Nc1cc(C)c(Cc2ccc(OC)c(C(C)C)c2)c(C)c1

nearest known ligand 0.66

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
THRB P10828 11/20 0.66
THRA P10827 10/20 0.66
GAA P10253 1/20 0.48
ATM Q13315 1/20 0.48
ALDH1A1 P00352 1/20 0.44
MAPT P10636 1/20 0.41
CYP19A1 P11511 1/20 0.39

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
SCHEMBL6864242 0.87 THRB (0.49) THRBTHRA
SCHEMBL6863345 0.81 THRB (0.44) THRBTHRAGAAALDH1A1
SCHEMBL6903617 0.81 MAPT (0.52) THRBTHRAGAAATMALDH1A1
SCHEMBL7085220 0.80 THRA (1.00) THRBTHRAALDH1A1
SCHEMBL282445 0.76 THRB (0.49) THRBTHRA
SCHEMBL7599524 0.76 THRB (0.47) THRBTHRA
SCHEMBL7114452 0.75 THRB (0.50) THRBTHRAGAA
SCHEMBL6864460 0.74 THRB (0.48) THRBTHRAGAAALDH1A1MAPT
SCHEMBL666032 0.74 THRB (0.43) THRBTHRAGAAALDH1A1
SCHEMBL667473 0.74 THRB (0.45) THRBTHRAALDH1A1

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-6803480-B2 THERAPEUTIC TREATMENT AND/OR PROPHYLAXIS OF ARTERIOSCLEROSIS AND HYPERCHOLESTEROLAEMIA BAYER AKTIENGESELLSCHAFT (DE) 2004-10-12 US disclosed
US-20030203898-A1 Therapeutic treatment and/or prophylaxis of arteriosclerosis and hypercholesterolaemia BAYER AKTIENGESELLSCHAFT (DE) 2003-10-30 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-20030203898-A1 Therapeutic treatment and/or prophylaxis of arteriosclerosis and hypercholesterolaemia APOB, HMGCR, PCSK9 THRB 2653/4885THRA 2817/4885GAA 1550/4885

“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.