SCHEMBL14645973

SCHEMBL14645973

CCCCCc1ccc(OC)c2c1C=C(C)[CH]2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 11/20 0.44
PTGS2 P35354 4/20 0.44
PPARA Q07869 1/20 0.40
HTR2A P28223 1/20 0.38
ELANE P08246 2/20 0.37
TYR P14679 1/20 0.36

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
SCHEMBL2853357 0.81 TYR (0.40) ALOX5PTGS2HTR2ATYR
SCHEMBL2851133 0.80 TYR (0.42) ALOX5PTGS2PPARAHTR2ATYR
SCHEMBL2852414 0.76 TYR (0.37) ALOX5TYR
SCHEMBL11808022 0.71 ALOX5 (0.53) ALOX5PTGS2PPARAHTR2A
SCHEMBL22413029 0.71 ALOX5 (0.49) ALOX5PTGS2PPARAHTR2ATYR
SCHEMBL8079270 0.70 LIPG (0.41) ALOX5PTGS2PPARATYR
SCHEMBL10771477 0.69 AOC3 (0.54) ALOX5PTGS2PPARAHTR2A
SCHEMBL10776215 0.69 AOC3 (0.54) ALOX5PTGS2PPARAHTR2A
SCHEMBL10618666 0.69 ALOX5 (0.50) ALOX5PTGS2PPARAHTR2AELANE
SCHEMBL28100250 0.69 AOC3 (0.54) ALOX5PTGS2PPARAHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2729479-B1 CATALYSTS BOREALIS AG (AT) 2017-09-06 EP disclosed
US-9630980-B2 Asymmetrical ligands BOREALIS AG (AT) 2017-04-25 US disclosed
US-20160024123-A1 Asymmetrical Ligands BOREALIS AG (AT) 2016-01-28 US disclosed
US-9187583-B2 Catalysts BOREALIS AG (AT) 2015-11-17 US disclosed
US-20140221584-A1 CATALYSTS BOREALIS AG (AT) 2014-08-07 US disclosed
EP-2729479-A1 CATALYSTS Borealis AG (AT) 2014-05-14 EP disclosed
WO-2013007650-A1 CATALYSTS BOREALIS AG (AT) 2013-01-17 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-20160024123-A1 Asymmetrical Ligands CCRL2, AR, CCR2 ALOX5 4188/4885PTGS2 1902/4885PPARA 2766/4885

“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.