SCHEMBL7063354

SCHEMBL7063354

O=C(O)COc1ccc(F)cc1C(=O)NCc1ccc(Br)cc1F

nearest known ligand 0.82

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 8/20 0.82
AKR1A1 P14550 1/20 0.70
PKM P14618 1/20 0.51
PTGDR2 Q9Y5Y4 7/20 0.49
AKR1B10 O60218 1/20 0.43
MMP2 P08253 1/20 0.43
LRRK2 Q5S007 1/20 0.43
PTGER4 P35408 1/20 0.43
PTGER2 P43116 1/20 0.43

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
SCHEMBL7066286 0.94 AKR1B1 (0.83) AKR1B1AKR1A1PKMPTGDR2AKR1B10
SCHEMBL7067029 0.91 AKR1B1 (0.82) AKR1B1AKR1A1PKMPTGDR2AKR1B10
SCHEMBL5459444 0.90 AKR1B1 (0.77) AKR1B1AKR1A1PTGDR2AKR1B10MMP2
SCHEMBL7065032 0.90 AKR1B1 (1.00) AKR1B1AKR1A1PTGDR2AKR1B10
SCHEMBL7067035 0.89 AKR1B1 (0.75) AKR1B1AKR1A1PTGDR2AKR1B10MMP2
SCHEMBL7065285 0.89 AKR1B1 (0.84) AKR1B1AKR1A1PTGDR2AKR1B10
SCHEMBL5462608 0.89 AKR1B1 (0.75) AKR1B1AKR1A1PKMPTGDR2AKR1B10
SCHEMBL7063287 0.89 AKR1B1 (0.78) AKR1B1AKR1A1PKMPTGDR2AKR1B10
SCHEMBL5466063 0.87 AKR1B1 (0.72) AKR1B1AKR1A1PKMPTGDR2MMP2
SCHEMBL7064157 0.87 AKR1B1 (0.72) AKR1B1AKR1A1PTGDR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030036558-A1 Substituted phenoxyacetic acids THE INSTITUTES OF PHARMACEUTICAL DISCOVERY LLC. 2003-02-20 US claimed
JP-2003503381-A 2003-01-28 JP claimed
US-6420426-B1 USED TO TREAT COMPLICATIONS FROM DIABETES MELLITUS THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2002-07-16 US claimed
EP-1198451-A2 SUBSTITUTED PHENOXYACETIC ACIDS The Institutes for Pharmaceutical Discovery, LLC (US) 2002-04-24 EP claimed
WO-2001000566-A2 SUBSTITUTED PHENOXYACETIC ACIDS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2001-01-04 WO claimed
US-20070161631-A1 Substituted Phenoxyacetic Acids PHARMACIA & UPJOHN COMPANY 2007-07-12 US disclosed
US-20070161631-A1 Substituted Phenoxyacetic Acids PHARMACIA & UPJOHN COMPANY 2007-07-12 US disclosed
US-7189749-B2 Substituted phenoxyacetic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2007-03-13 US disclosed
US-7189749-B2 Substituted phenoxyacetic acids THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC (US) 2007-03-13 US disclosed
US-20030036558-A1 Substituted phenoxyacetic acids THE INSTITUTES OF PHARMACEUTICAL DISCOVERY LLC. 2003-02-20 US 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-20070161631-A1 Substituted Phenoxyacetic Acids SLC5A2, GPR119, SLC5A1 AKR1B1 708/4885AKR1A1 791/4885PKM 725/4885
US-20030036558-A1 Substituted phenoxyacetic acids SLC5A2, GPR119, SLC5A1 AKR1B1 708/4885AKR1A1 791/4885PKM 725/4885

“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.