SCHEMBL10328529

SCHEMBL10328529

C=C(CCC)c1coc(C(=O)O)cc1=O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 4/20 0.34
KDM4E B2RXH2 4/20 0.33
PDE5A O76074 2/20 0.33
USP2 O75604 1/20 0.33
CSNK2A2 P19784 1/20 0.33
PTGS1 P23219 1/20 0.33
CSNK2B P67870 1/20 0.33
CSNK2A1 P68400 1/20 0.33
CSNK2A3 Q8NEV1 1/20 0.33
MAOB P27338 4/20 0.33
ALDH1A1 P00352 3/20 0.32
PKM P14618 1/20 0.32
AKR1B1 P15121 1/20 0.32
ABCB11 O95342 1/20 0.32
PTGER4 P35408 1/20 0.31
KMT2A Q03164 2/20 0.31
TDP1 Q9NUW8 2/20 0.31
MEN1 O00255 1/20 0.31
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL18473807 0.76 KDM4E (0.39) GPR35KDM4EUSP2CSNK2A2PTGS1
SCHEMBL3334784 0.71 PTPN1 (0.40) GPR35KDM4EPDE5AUSP2CSNK2A2
SCHEMBL10328652 0.70 ALDH1A1 (0.36) GPR35KDM4EUSP2CSNK2A2PTGS1
SCHEMBL6900481 0.70 MEN1 (0.42) GPR35PDE5APTGER4KMT2ATDP1
SCHEMBL10328546 0.69 PDE2A (0.41) GPR35KDM4EALDH1A1PKMABCB11
SCHEMBL10328605 0.69 MEN1 (0.48) ALDH1A1KMT2ATDP1MEN1HPGD
SCHEMBL10328545 0.68 FABP3 (0.41) GPR35KDM4EUSP2CSNK2A2PTGS1
SCHEMBL10328625 0.68 F13A1 (0.41) GPR35ALDH1A1
SCHEMBL10328548 0.68 MEN1 (0.50) ALDH1A1KMT2ATDP1MEN1HPGD
SCHEMBL10032704 0.68 KDM4E (0.42) GPR35KDM4EUSP2CSNK2A2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8748483-B2 Use of substituted pyranone acid derivatives for the treatment of metabolic syndrome SANOFI (FR) 2014-06-10 US disclosed
US-8748483-B2 Use of substituted pyranone acid derivatives for the treatment of metabolic syndrome SANOFI (FR) 2014-06-10 US disclosed
EP-2120923-B1 USE OF SUBSTITUTED PYRANONE ACID DERIVATIVES FOR THE TREATMENT OF METABOLIC SYNDROME SANOFI SA (FR) 2012-07-18 EP disclosed
US-20100144862-A1 USE OF SUBSTITUTED PYRANONE ACID DERIVATIVES FOR THE TREATMENT OF METABOLIC SYNDROME SANOFI-AVENTIS (FR) 2010-06-10 US disclosed
US-20100144862-A1 USE OF SUBSTITUTED PYRANONE ACID DERIVATIVES FOR THE TREATMENT OF METABOLIC SYNDROME SANOFI-AVENTIS (FR) 2010-06-10 US disclosed
WO-2008086949-A1 USE OF SUBSTITUTED PYRANONE ACID DERIVATIVES FOR THE TREATMENT OF METABOLIC SYNDROME SANOFI-AVENTIS (FR) 2008-07-24 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-20100144862-A1 USE OF SUBSTITUTED PYRANONE ACID DERIVATIVES FOR THE TREATMENT OF METABOLIC SYNDROME PC, PCK1, PDK4 GPR35 1253/4885KDM4E 3593/4885PDE5A 2616/4885

“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.