SCHEMBL434696

SCHEMBL434696

N#CC(CC(=O)O)c1ccc(O)cc1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 8/20 0.58
ESR2 Q92731 8/20 0.58
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
ALDH1A1 P00352 1/20 0.58
CYP1A2 P05177 1/20 0.58
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
FFAR1 O14842 10/20 0.45

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
SCHEMBL1343883 0.85 FFAR1 (0.51) KMT2ACYP2C19FFAR1
SCHEMBL9556420 0.85 FFAR1 (0.51) KMT2ACYP2C19FFAR1
SCHEMBL27862777 0.85 FFAR1 (0.51) KMT2ACYP2C19FFAR1
SCHEMBL20408613 0.84 FFAR1 (0.60) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL18382535 0.84 FFAR1 (0.60) KMT2AMEN1CYP1A2CYP3A4CYP2C9
SCHEMBL17144644 0.84 FFAR1 (0.44) ESR1ESR2KMT2AMEN1ALDH1A1
SCHEMBL6801487 0.84 ESR1 (0.56) ESR1ESR2KMT2AMEN1ALDH1A1
SCHEMBL10260682 0.84 FFAR1 (0.62) KMT2AALDH1A1FFAR1
SCHEMBL5326314 0.84 FFAR1 (0.60) KMT2AALDH1A1FFAR1
SCHEMBL11891939 0.81 ESR1 (0.58) ESR1ESR2KMT2AMEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595952-B1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-11-18 EP disclosed
EP-2595952-B1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-11-18 EP disclosed
CN-110003169-A GPR40 receptor agonist, method for preparing same, and pharmaceutical composition containing same as active ingredient 株式会社LG化学 2019-07-12 CN disclosed
US-9278915-B2 Agonists of GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2016-03-08 US disclosed
US-9278915-B2 Agonists of GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2016-03-08 US disclosed
US-9278915-B2 Agonists of GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2016-03-08 US disclosed
US-20130237571-A1 AGONISTS OF GPR40 Conexios Life Sciences PVT. LTD. (IN) 2013-09-12 US disclosed
US-20130237571-A1 AGONISTS OF GPR40 Conexios Life Sciences PVT. LTD. (IN) 2013-09-12 US disclosed
US-20130237571-A1 AGONISTS OF GPR40 Conexios Life Sciences PVT. LTD. (IN) 2013-09-12 US disclosed
EP-2595952-A1 AGONISTS OF GPR40 Connexios Life Sciences Pvt. Ltd. (IN) 2013-05-29 EP disclosed
WO-2013057743-A1 PROCESS FOR THE PREPARATION OF AN ARYL OXIME AND SALTS THEREOF CONNEXIOS LIFE SCIENCES PVT. LTD (IN) 2013-04-25 WO disclosed
WO-2013057743-A1 PROCESS FOR THE PREPARATION OF AN ARYL OXIME AND SALTS THEREOF CONNEXIOS LIFE SCIENCES PVT. LTD (IN) 2013-04-25 WO disclosed
WO-2012011125-A1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT. LTD. (IN) 2012-01-26 WO disclosed
WO-2012011125-A1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT. LTD. (IN) 2012-01-26 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-20130237571-A1 AGONISTS OF GPR40 GPR65, GPR55, GPR68 ESR1 231/4885ESR2 183/4885KMT2A 3880/4885

“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.