SCHEMBL5117961

SCHEMBL5117961

COC(=O)C1Cc2ccc(OCCc3ccccc3)cc2OC1=O

nearest known ligand 0.70

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.70
PPARA Q07869 10/20 0.70
MAOB P27338 9/20 0.49
MAOA P21397 7/20 0.49
BRD4 O60885 1/20 0.48
CREBBP Q92793 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
SCHEMBL14013303 0.84 PPARG (0.60) PPARGPPARA
SCHEMBL5112742 0.77 PPARG (0.57) PPARGPPARAMAOBMAOA
SCHEMBL5115432 0.76 PPARG (0.58) PPARGPPARA
SCHEMBL5116383 0.75 PPARG (0.48) PPARGPPARA
SCHEMBL12283677 0.73 PPARG (0.51) PPARGPPARAMAOB
SCHEMBL28999685 0.72 PPARG (0.48) PPARGPPARAMAOB
SCHEMBL28999667 0.72 PPARG (0.54) PPARGPPARAMAOB
SCHEMBL29587436 0.68 PPARG (0.61) PPARGPPARAMAOBMAOA
SCHEMBL18983468 0.68 S1PR5 (0.55) MAOBMAOA
SCHEMBL29586780 0.68 PPARG (0.54) PPARGPPARAMAOBMAOABRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060178405-A1 Benzopyran compounds, process for preparing the same and their use SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2006-08-10 US claimed
EP-1598345-A1 BENZOPYRAN COMPOUNDS, PROCESS FOR PREPARING THE SAME AND THEIR USE SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2005-11-23 EP claimed
US-7456205-B2 Benzopyran compounds, process for preparing the same and their use SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2008-11-25 US disclosed
US-20060178405-A1 Benzopyran compounds, process for preparing the same and their use SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2006-08-10 US disclosed
EP-1598345-A1 BENZOPYRAN COMPOUNDS, PROCESS FOR PREPARING THE SAME AND THEIR USE SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2005-11-23 EP 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-20060178405-A1 Benzopyran compounds, process for preparing the same and their use SLC5A2, CYP2D6, IAPP PPARG 670/4885PPARA 414/4885MAOB 804/4885

“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.