SCHEMBL10328673

SCHEMBL10328673

O=C(O)c1cc(=O)c(OCc2ccc(OC(F)F)cc2)co1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 1/20 0.48
ALKBH1 Q13686 2/20 0.46
PTGER4 P35408 2/20 0.46
NPC1 O15118 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2C19 P33261 1/20 0.45
RECQL P46063 1/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PPARG P37231 2/20 0.39
PPARA Q07869 2/20 0.39
LMNA P02545 2/20 0.39
POLB P06746 1/20 0.39
DAO P14920 1/20 0.38
LDHA P00338 2/20 0.38
NLRP3 Q96P20 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
NR4A2 P43354 1/20 0.37

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
SCHEMBL10328539 0.85 PTGER4 (0.49) PTGER4NPC1CYP1A2CYP2C19RECQL
SCHEMBL9356623 0.84 RAB9A (0.52) MRGPRX4ALKBH1PTGER4NPC1CYP1A2
SCHEMBL10328594 0.83 MEN1 (0.50) PTGER4NPC1CYP1A2CYP2C19RECQL
SCHEMBL13323405 0.83 MRGPRX4 (0.48) MRGPRX4PTGER4NPC1CYP1A2CYP2C19
SCHEMBL1037140 0.82 PTGER4 (0.52) PTGER4NPC1CYP1A2CYP2C19RECQL
SCHEMBL10328616 0.81 RXRA (0.52) MRGPRX4PTGER4NPC1CYP1A2CYP2C19
SCHEMBL10328650 0.81 RAB9A (0.50) MRGPRX4PTGER4NPC1CYP1A2CYP2C19
SCHEMBL10328621 0.81 NPC1 (0.53) MRGPRX4PTGER4NPC1CYP1A2CYP2C19
SCHEMBL10328542 0.81 MRGPRX4 (0.50) MRGPRX4PTGER4NPC1CYP1A2CYP2C19
SCHEMBL3334602 0.81 NPC1 (0.67) MRGPRX4PTGER4NPC1CYP1A2CYP2C19

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 MRGPRX4 2140/4885ALKBH1 4115/4885PTGER4 1564/4885

“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.