SCHEMBL4221571

SCHEMBL4221571

CCO/C(=C\c1ccc(-c2cccc(NC)c2)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.50
PTGS2 P35354 1/20 0.41
SYK P43405 1/20 0.40
MGLL Q99685 4/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ITGB3 P05106 1/20 0.39
ITGAV P06756 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL4221578 1.00 DHODH (0.50) DHODHPTGS2SYKMGLLMEN1
SCHEMBL4220313 0.87 TP53 (0.43) DHODHPTGS2MGLLMEN1KMT2A
SCHEMBL4220316 0.87 TP53 (0.43) DHODHPTGS2MGLLMEN1KMT2A
SCHEMBL4220307 0.87 TP53 (0.43) DHODHPTGS2MGLLMEN1KMT2A
SCHEMBL4217379 0.85 DHODH (0.41) DHODHSYKMEN1KMT2ATP53
SCHEMBL4217374 0.85 DHODH (0.41) DHODHSYKMEN1KMT2ATP53
SCHEMBL4210723 0.83 DHODH (0.53) DHODHSYKMEN1KMT2AITGB3
SCHEMBL4210720 0.83 DHODH (0.53) DHODHSYKMEN1KMT2AITGB3
SCHEMBL4213907 0.82 DHODH (0.52) DHODHSYKMGLLMEN1KMT2A
SCHEMBL4222173 0.82 DHODH (0.52) DHODHPTGS2SYKMEN1KMT2A

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 DHODH 2932/4885PTGS2 1120/4885SYK 4815/4885

“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.