SCHEMBL5118310

SCHEMBL5118310

CCCN1C(=O)/C(=N\NC(=O)Nc2ccccc2)c2cc(SCCc3ccc(C(=O)O)cc3)ccc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 1/20 0.41
CA12 O43570 5/20 0.39
CA1 P00915 5/20 0.39
CA2 P00918 5/20 0.39
CA9 Q16790 5/20 0.39
KDR P35968 1/20 0.39
MCL1 Q07820 2/20 0.38
BCL2A1 Q16548 2/20 0.38
CCKBR P32239 3/20 0.37
BDKRB1 P46663 3/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
TRPV1 Q8NER1 1/20 0.34
HDAC1 Q13547 1/20 0.34

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
SCHEMBL5113251 1.00 PARK7 (0.41) PARK7CA12CA1CA2CA9
SCHEMBL14287374 1.00 PARK7 (0.41) PARK7CA12CA1CA2CA9
SCHEMBL5111370 0.95 PARK7 (0.40) PARK7CA12CA1CA2CA9
SCHEMBL5111360 0.95 PARK7 (0.40) PARK7CA12CA1CA2CA9
SCHEMBL14287334 0.95 PARK7 (0.40) PARK7CA12CA1CA2CA9
SCHEMBL5110405 0.94 PARK7 (0.40) PARK7CA12CA1CA2CA9
SCHEMBL5110403 0.94 PARK7 (0.40) PARK7CA12CA1CA2CA9
SCHEMBL5110558 0.94 PARK7 (0.40) PARK7CA12CA1CA2CA9
SCHEMBL5111211 0.94 PARK7 (0.48) PARK7CA12CA1CA2CA9
SCHEMBL5111207 0.94 PARK7 (0.48) PARK7CA12CA1CA2CA9

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-20080004274-A1 Novel biaromatic compounds that modulate PPAR type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-03 US claimed
EP-1828124-A1 BIAROMATIC COMPOUNDS THAT MODULATE PPAR TYPE RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development (FR) 2007-09-05 EP claimed
WO-2006063863-A1 BIAROMATIC COMPOUNDS THAT MODULATE PPAR TYPE RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT (FR) 2006-06-22 WO claimed
US-20080004274-A1 Novel biaromatic compounds that modulate PPAR type receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-01-03 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 (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-20080004274-A1 Novel biaromatic compounds that modulate PPAR type receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARD, PPARA PARK7 2430/4885CA12 4873/4885CA1 4882/4885

“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.