SCHEMBL6098935

SCHEMBL6098935

CCCc1c(OCCCN2CCCCC2=O)ccc2c(CC(C)(C)C)noc12

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.52
NR1H2 P55055 13/20 0.49
NR1H3 Q13133 13/20 0.49
PPARD Q03181 13/20 0.42
PPARA Q07869 13/20 0.42
PPARG P37231 10/20 0.42
P2RY12 Q9H244 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
SCHEMBL5576769 0.86 NR1H2 (0.56) GRM2NR1H2NR1H3PPARDPPARA
SCHEMBL6099203 0.85 NR1H3 (0.67) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6407458 0.84 NR1H2 (0.41) GRM2NR1H2NR1H3PPARDPPARA
SCHEMBL6102250 0.84 NR1H3 (0.66) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6422304 0.83 GRM2 (0.58) GRM2NR1H2NR1H3PPARDPPARA
SCHEMBL6098942 0.81 GRM2 (0.55) GRM2NR1H2NR1H3PPARDPPARA
SCHEMBL6097922 0.81 NR1H2 (0.74) GRM2NR1H2NR1H3PPARDPPARA
SCHEMBL6406097 0.78 NR1H2 (0.47) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6100087 0.78 GRM2 (0.63) GRM2NR1H2NR1H3PPARDPPARA
SCHEMBL6175566 0.77 GRM2 (0.60) GRM2NR1H2NR1H3PPARDPPARA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125865-B2 Therapeutic compounds for treating dyslipidemic conditions MERCK & CO., INC. (US) 2006-10-24 US claimed
US-20050239769-A1 Therapeutic compounds for treating dyslipidemic conditions MERCK SHARP & DOHME CORP. 2005-10-27 US claimed
US-7125865-B2 Therapeutic compounds for treating dyslipidemic conditions MERCK & CO., INC. (US) 2006-10-24 US disclosed
US-20050239769-A1 Therapeutic compounds for treating dyslipidemic conditions MERCK SHARP & DOHME CORP. 2005-10-27 US disclosed
EP-1534696-A1 THERAPEUTIC COMPOUNDS FOR TREATING DYSLIPIDEMIC CONDITIONS Merck & Co., Inc. (US) 2005-06-01 EP disclosed
WO-2004011448-A1 THERAPEUTIC COMPOUNDS FOR TREATING DYSLIPIDEMIC CONDITIONS MERCK & CO., INC. (US) 2004-02-05 WO 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-20050239769-A1 Therapeutic compounds for treating dyslipidemic conditions NR1H2, NR1H3, LDLR GRM2 541/4885NR1H2 1/4885NR1H3 2/4885

“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.