SCHEMBL6702485

SCHEMBL6702485

CC(Cc1ccc(OCc2nc3ccc(O)cc3n2C)cc1)C(O)=S

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESRRA P11474 1/20 0.48
NPC1 O15118 3/20 0.47
RAB9A P51151 3/20 0.47
PPARG P37231 15/20 0.45
CNR2 P34972 1/20 0.42

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
Hydrochloric Acid SCHEMBL6702790 0.99 ESRRA (0.48) ESRRANPC1RAB9APPARGCNR2
SCHEMBL6703330 0.91 PPARG (0.55) ESRRANPC1RAB9APPARG
SCHEMBL6705079 0.91 ESRRA (0.46) ESRRANPC1RAB9APPARGCNR2
Hydrochloric Acid SCHEMBL6697824 0.90 PPARG (0.55) ESRRANPC1RAB9APPARG
SCHEMBL6705167 0.89 NPC1 (0.45) ESRRANPC1RAB9APPARG
Hydrochloric Acid SCHEMBL6700231 0.88 PPARG (0.45) ESRRANPC1RAB9APPARG
Hydrochloric Acid SCHEMBL6703924 0.87 PPARG (0.44) ESRRANPC1RAB9APPARGCNR2
SCHEMBL6702478 0.86 PPARG (0.46) ESRRANPC1RAB9APPARG
Hydrochloric Acid SCHEMBL6702781 0.85 PPARG (0.47) ESRRANPC1RAB9APPARG
Hydrochloric Acid SCHEMBL6703913 0.82 PPARG (0.44) ESRRAPPARGCNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040002512-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-01 US claimed
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-04-10 US claimed
EP-1167357-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP claimed
US-20040002512-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2004-01-01 US disclosed
US-6596751-B2 An insulin resistance improving agent, hypoglycemic agent, immunoregulatory agent, aldose reductase inhibitor, 5-lipoxygenase inhibitor, peroxidized lipid production suppressor, PPAR. activator, leukotriene antagonist, adipose SANKYO COMPANY LIMITED (JP) 2003-07-22 US disclosed
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SANKYO COMPANY, LIMITED (JP) 2003-04-10 US disclosed
EP-1167357-A1 ALPHA-SUBSTITUTED CARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 2002-01-02 EP 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 (2 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-20040002512-A1 Alpha-substituted carboxylic acid derivatives SLC5A1, SLC2A1, GPR119 ESRRA 379/4885NPC1 2139/4885RAB9A 2079/4885
US-20030069294-A1 Alpha-substituted carboxylic acid derivatives SLC5A1, SLC2A1, GPR119 ESRRA 379/4885NPC1 2139/4885RAB9A 2079/4885

“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.