SCHEMBL5114729

SCHEMBL5114729

O=C(N/N=C1\C(=O)N(CCc2ccccc2)c2ccc(SCCc3ccc(C(=O)O)cc3)cc21)Nc1ccc(F)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARK7 Q99497 3/20 0.44
MCL1 Q07820 2/20 0.38
BCL2A1 Q16548 2/20 0.38
MAPT P10636 4/20 0.37
TP53 P04637 1/20 0.37
CA12 O43570 6/20 0.36
CA1 P00915 6/20 0.36
CA2 P00918 5/20 0.36
CA9 Q16790 5/20 0.36
ALDH1A1 P00352 3/20 0.36
HTT P42858 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
UBE2N P61088 1/20 0.36
CCKBR P32239 1/20 0.36
CA4 P22748 1/20 0.36
CA7 P43166 1/20 0.36
POLB P06746 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
SCHEMBL5114732 1.00 PARK7 (0.44) PARK7MCL1BCL2A1MAPTTP53
SCHEMBL14287339 1.00 PARK7 (0.44) PARK7MCL1BCL2A1MAPTTP53
SCHEMBL5111207 0.94 PARK7 (0.48) PARK7MCL1BCL2A1CA12CA1
SCHEMBL5111211 0.94 PARK7 (0.48) PARK7MCL1BCL2A1CA12CA1
SCHEMBL5113928 0.93 CA12 (0.40) PARK7MCL1BCL2A1CA12CA1
SCHEMBL14287366 0.93 CA12 (0.40) PARK7MCL1BCL2A1CA12CA1
SCHEMBL5113932 0.93 CA12 (0.40) PARK7MCL1BCL2A1CA12CA1
SCHEMBL5117168 0.93 PARK7 (0.39) PARK7MAPTALDH1A1HTTKMT2A
SCHEMBL5124128 0.93 PARK7 (0.39) PARK7MAPTALDH1A1HTTKMT2A
SCHEMBL5216451 0.92 PARK7 (0.43) PARK7MCL1BCL2A1MAPTCA12

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 2 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

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 2430/4885MCL1 1860/4885BCL2A1 897/4885

“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.