SCHEMBL2083574

SCHEMBL2083574

CCCCOc1cc(CCC(=O)OC)ccc1-c1cccc(N(C)C(=O)Nc2ccccc2)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.41
HDAC1 Q13547 2/20 0.41
HDAC2 Q92769 2/20 0.41
SENP1 Q9P0U3 2/20 0.39
FFAR1 O14842 2/20 0.37
AKR1C3 P42330 1/20 0.36
CNR1 P21554 1/20 0.36
CNR2 P34972 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
ALOX15 P16050 1/20 0.36
MCHR1 Q99705 1/20 0.36
TSHR P16473 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
LTA4H P09960 1/20 0.36
THRA P10827 1/20 0.35
THRB P10828 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
SCHEMBL2084745 0.93 FFAR1 (0.42) HDAC1HDAC2SENP1FFAR1
SCHEMBL2085477 0.87 CNR1 (0.38) PTPN1HDAC1HDAC2CNR1CNR2
SCHEMBL2087508 0.86 CNR1 (0.39) PTPN1CNR1CNR2ALDH1A1
SCHEMBL2085545 0.85 CNR1 (0.40) PTPN1CNR1CNR2THRATHRB
SCHEMBL2083153 0.84 CNR1 (0.41) PTPN1CNR1CNR2THRATHRB
SCHEMBL2083383 0.84 CNR1 (0.39) PTPN1CNR1CNR2
SCHEMBL2083493 0.82 CNR1 (0.38) PTPN1CNR1CNR2THRATHRB
SCHEMBL2085110 0.82 CNR1 (0.38) PTPN1CNR1CNR2ALDH1A1
SCHEMBL2083810 0.82 CNR1 (0.38) PTPN1CNR1CNR2
SCHEMBL2084837 0.82 MTNR1A (0.43) PTPN1FFAR1ALDH1A1SIRT2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7863332-B2 Biaromatic compound activators of PPARγ receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2011-01-04 US disclosed
EP-1781297-B1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2008-10-15 EP disclosed
US-20070213336-A1 Biaromatic compound activators of ppargamma receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-13 US disclosed
EP-1781297-A1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-05-09 EP disclosed
WO-2006018326-A1 NOVEL BIAROMATIC COMPOUNDS THAT ACTIVATE PPAR TYPE RECEPTORS, AND USE THEREOF IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2006-02-23 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-20070213336-A1 Biaromatic compound activators of ppargamma receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD PTPN1 1201/4885HDAC1 257/4885HDAC2 194/4885

“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.