SCHEMBL4212795

SCHEMBL4212795

CCCCOc1cc(/C=C(\CC)C(=O)O)ccc1I

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 8/20 0.47
PTGES O14684 6/20 0.42
PPARG P37231 3/20 0.42
KDM4E B2RXH2 1/20 0.41
AKR1C3 P42330 1/20 0.39
XDH P47989 1/20 0.39
PSEN1 P49768 3/20 0.39
PSEN2 P49810 1/20 0.39
APH1B Q8WW43 1/20 0.39
NCSTN Q92542 1/20 0.39
APH1A Q96BI3 1/20 0.39
PSENEN Q9NZ42 1/20 0.39
TBXAS1 P24557 2/20 0.38
ESR1 P03372 2/20 0.37
POLB P06746 1/20 0.37
TTR P02766 1/20 0.37

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
SCHEMBL4227793 1.00 ALOX5 (0.47) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL4220644 1.00 ALOX5 (0.47) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL4229402 0.88 POLB (0.38) ALOX5PTGESPPARGKDM4EPSEN1
SCHEMBL4210545 0.86 ALDH1A1 (0.40) ALOX5KDM4EESR1
SCHEMBL68302 0.86 KDM4E (0.42) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL68303 0.86 KDM4E (0.42) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL4215918 0.86 KDM4E (0.42) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL3632523 0.84 KDM4E (0.43) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL3632522 0.84 KDM4E (0.43) ALOX5PTGESPPARGKDM4EAKR1C3
SCHEMBL3632799 0.84 KDM4E (0.43) ALOX5PTGESPPARGKDM4EAKR1C3

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-8383652-B2 Biaromatic compounds that modulate PPAR-receptors GALDERMA RESEARCH & DEVELOPMENT (FR) 2013-02-26 US disclosed
US-20090012129-A1 NOVEL BIAROMATIC COMPOUNDS THAT MODULATE PPAR-RECEPTORS GALDERMA RESEARCH & DEVELOPMENT (FR) 2009-01-08 US disclosed
EP-1943213-A2 PPAR MODULATING BIAROMATIC COMPOUNDS Galderma Research & Development (FR) 2008-07-16 EP disclosed
WO-2007049158-A2 PPAR MODULATING BIAROMATIC COMPOUNDS GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-05-03 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-20090012129-A1 NOVEL BIAROMATIC COMPOUNDS THAT MODULATE PPAR-RECEPTORS PPARG, PPARD, PPARA ALOX5 713/4885PTGES 431/4885PPARG 1/4885

“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.