Benzene

Benzene

SCHEMBL1825335

COC(Cc1ccc(OCCn2cccc2C)cc1)C(=O)O.c1ccccc1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 19/20 0.60
PPARA Q07869 16/20 0.60
PPARD Q03181 9/20 0.60
PGR P06401 1/20 0.45
ADORA3 P0DMS8 1/20 0.45
CHRM1 P11229 1/20 0.45
TBXA2R P21731 1/20 0.45
PTGS1 P23219 1/20 0.45
SLC6A2 P23975 1/20 0.45
PDE4A P27815 1/20 0.45
ADRA1A P35348 1/20 0.45
DRD3 P35462 1/20 0.45

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
Ethane SCHEMBL1834451 0.88 PPARA (0.63) PPARGPPARAPPARDPGRADORA3
SCHEMBL543205 0.83 PPARG (0.62) PPARGPPARAPPARDPGRADORA3
SCHEMBL27654978 0.81 PPARA (0.76) PPARGPPARAPPARD
SCHEMBL5394822 0.80 PPARG (0.84) PPARGPPARAPPARD
SCHEMBL5383883 0.79 PPARA (0.84) PPARGPPARAPPARD
SCHEMBL5383887 0.79 PPARA (0.84) PPARGPPARAPPARD
SCHEMBL27674846 0.79 PPARA (0.84) PPARGPPARAPPARD
SCHEMBL5375774 0.79 PPARG (0.92) PPARGPPARAPPARD
SCHEMBL543437 0.78 PGR (0.66) PPARGPPARAPPARDPGRADORA3
SCHEMBL7532753 0.77 PPARG (0.80) PPARGPPARAPPARD

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-8212057-B2 Pyrroles having hypolipidemic hypocholesteremic activities, process for their preparation and pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED (IN) 2012-07-03 US disclosed
EP-1414439-B1 NOVEL PYRROLES HAVING HYPOLIPIDEMIC HYPOCHOLESTEREMIC ACTIVITIES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE IN MEDICINE CADILA HEALTHCARE LTD (IN) 2011-05-04 EP disclosed
US-20070238776-A1 Novel Pyrroles Having Hypolipidemic Hypocholesteremic Activities, Process for Their Preparation and Pharmaceutical Compositions Containing Them and Their Use in Medicine CADILLA HEALTHCARE LIMITED (IN) 2007-10-11 US disclosed
US-7041837-B2 Heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine CADILLA HEALTHCARE LIMITED (IN) 2006-05-09 US disclosed
US-20030236254-A1 Novel heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine CADILA HEALTHCARE LIMITED (IN) 2003-12-25 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 (2 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-20070238776-A1 Novel Pyrroles Having Hypolipidemic Hypocholesteremic Activities, Process for Their Preparation and Pharmaceutical Compositions Containing Them and Their Use in Medicine LIPC, CETP, PNLIP PPARG 217/4885PPARA 126/4885PPARD 133/4885
US-20030236254-A1 Novel heterocyclic compounds having hypolipidemic, hypocholesteremic activities process for their preparation and pharmaceutical compositions containing them and their use in medicine LIPA, LIPC, CYP46A1 PPARG 129/4885PPARA 68/4885PPARD 143/4885

“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.