SCHEMBL7528025

SCHEMBL7528025

CCOC(Cc1ccc(OCCN2CCSc3ccccc32)cc1)C(=O)O.OCCNc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.53
PPARA Q07869 17/20 0.52
PPARD Q03181 3/20 0.49
LMNA P02545 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48

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
SCHEMBL14265747 0.91 PPARG (0.63) PPARGPPARAPPARDLMNATP53
SCHEMBL7255050 0.91 PPARG (0.63) PPARGPPARAPPARDLMNATP53
SCHEMBL5081077 0.91 PPARG (0.63) PPARGPPARAPPARDLMNATP53
Tromethamine SCHEMBL7525169 0.87 PPARG (0.56) PPARGPPARAPPARDLMNATP53
N-Benzylmethylamine SCHEMBL7524220 0.86 PPARG (0.56) PPARGPPARAPPARDLMNATP53
SCHEMBL5107699 0.85 LMNA (0.54) PPARGPPARAPPARDLMNATP53
SCHEMBL1858261 0.85 PPARG (0.46) PPARGPPARAPPARDLMNATP53
SCHEMBL6282152 0.85 PPARG (0.63) PPARGPPARAPPARD
SCHEMBL7526238 0.84 PPARG (0.59) PPARGPPARAPPARD
SCHEMBL7528648 0.84 PPARG (0.53) PPARGPPARAPPARDLMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020142993-A1 Pharmaceutically acceptable salts of bicyclic compounds DR. REDDY'S LABORATORIES LTD. 2002-10-03 US claimed
WO-2002030914-A1 SALTS OF BENZOTHIAZINE AND BENZOXAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 2002-04-18 WO claimed
US-20020142993-A1 Pharmaceutically acceptable salts of bicyclic compounds DR. REDDY'S LABORATORIES LTD. 2002-10-03 US disclosed
WO-2002030914-A1 SALTS OF BENZOTHIAZINE AND BENZOXAZINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S RESEARCH FOUNDATION (IN) 2002-04-18 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-20020142993-A1 Pharmaceutically acceptable salts of bicyclic compounds CYP3A43, ABCG2, SLC10A1 PPARG 411/4885PPARA 1234/4885PPARD 471/4885

“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.