SCHEMBL5118132

SCHEMBL5118132

CCCCN1C(=O)/C(=N\NC(=O)Nc2ccccc2)c2cc(SCCc3ccc(C(=O)OC)cc3)ccc21

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 9/20 0.39
▸ CCKBR P32239 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ TRPV1 Q8NER1 1/20 0.36
▸ AGTR2 P50052 2/20 0.35
▸ PARK7 Q99497 1/20 0.35
▸ ITGB3 P05106 1/20 0.35
▸ ITGAV P06756 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35

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
SCHEMBL5118137 1.00 AGTR1 (0.39) AGTR1CCKBRALDH1A1SMN1; SMN2RAB9A
SCHEMBL5124424 0.97 AGTR1 (0.37) AGTR1ALDH1A1SMN1; SMN2RAB9AITGB3
SCHEMBL5114533 0.97 AGTR1 (0.37) AGTR1ALDH1A1SMN1; SMN2RAB9AITGB3
SCHEMBL14287334 0.93 PARK7 (0.40) CCKBRTRPV1PARK7ITGB3ITGAV
SCHEMBL5111370 0.93 PARK7 (0.40) CCKBRTRPV1PARK7ITGB3ITGAV
SCHEMBL5111360 0.93 PARK7 (0.40) CCKBRTRPV1PARK7ITGB3ITGAV
SCHEMBL5145533 0.92 MAPT (0.39) ALDH1A1SMN1; SMN2TRPV1ITGB3ITGAV
SCHEMBL5145524 0.92 MAPT (0.39) ALDH1A1SMN1; SMN2TRPV1ITGB3ITGAV
SCHEMBL5110558 0.91 PARK7 (0.40) CCKBRTRPV1PARK7ITGB3ITGAV
SCHEMBL5110405 0.91 PARK7 (0.40) CCKBRTRPV1PARK7ITGB3ITGAV

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
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
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
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 AGTR1 638/4885CCKBR 2480/4885ALDH1A1 420/4885

“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.

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