SCHEMBL4967992

SCHEMBL4967992

CCCCOc1cc(CCC(=O)OC)ccc1-c1cccc(CNC)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 1/20 0.47
FFAR1 O14842 7/20 0.44
PTPN1 P18031 2/20 0.42
FFAR4 Q5NUL3 1/20 0.41
TLR7 Q9NYK1 1/20 0.41
PTPN11 Q06124 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
RXRA P19793 1/20 0.39
AKR1C3 P42330 1/20 0.39
S1PR2 O95136 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
LPAR2 Q9HBW0 1/20 0.38
CNR2 P34972 1/20 0.38

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
SCHEMBL5505115 0.87 FFAR1 (0.42) FFAR1PTPN1FFAR4TLR7PTPN11
SCHEMBL2085769 0.87 PTPN1 (0.43) FFAR1PTPN1TLR7HDAC1HDAC2
SCHEMBL4969393 0.84 AKR1C3 (0.41) FFAR1PTPN1TLR7PTPN11HDAC1
SCHEMBL4967970 0.84 AKR1C3 (0.40) FFAR1PTPN1TLR7PTPN11RXRA
SCHEMBL4968022 0.83 PTPN11 (0.41) FFAR1PTPN1PTPN11RXRAAKR1C3
SCHEMBL4969375 0.83 PTPN11 (0.41) FFAR1PTPN1PTPN11RXRAAKR1C3
SCHEMBL4970767 0.82 KMT2A (0.42) FFAR1PTPN1AKR1C3
SCHEMBL68430 0.82 HDAC1 (0.39) PTPN1TLR7HDAC1HDAC2RXRA
SCHEMBL4971612 0.81 GLS (0.40) FFAR1PTPN1TLR7PTPN11HDAC1
SCHEMBL4970326 0.81 HSD17B2 (0.46) FFAR1PTPN11HDAC1HDAC2

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
EP-1781274-B1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE RECEPTORS OF PPAR TYPE AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS GALDERMA RES & DEV (FR) 2008-11-05 EP disclosed
US-20070207175-A1 Biaromatic compound activators of PPARgamma receptors and cosmetic/pharmaceutical compositions comprised thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2007-09-06 US disclosed
EP-1781274-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE RECEPTORS OF PPAR TYPE AND THEIR USE IN COSMETIC OR PHARMACEUTICAL COMPOSITIONS Galderma Research & Development, S.N.C. (FR) 2007-05-09 EP disclosed
WO-2006018325-A1 NOVEL BIAROMATIC COMPOUNDS WHICH ACTIVATE RECEPTORS OF PPAR TYPE AND THEIR USE 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-20070207175-A1 Biaromatic compound activators of PPARgamma receptors and cosmetic/pharmaceutical compositions comprised thereof PPARG, PPARA, PPARD HTR7 1224/4885FFAR1 13/4885PTPN1 1201/4885

“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.