SCHEMBL7065032

SCHEMBL7065032

O=C(O)COc1ccccc1C(=O)NCc1ccc(Br)cc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 7/20 1.00
AKR1A1 P14550 1/20 0.66
PTGDR2 Q9Y5Y4 4/20 0.50
MAPT P10636 3/20 0.47
LMNA P02545 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
AKR1B10 O60218 1/20 0.47
SGMS2 Q8NHU3 1/20 0.46
ALDH1A1 P00352 1/20 0.46
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
PLA2G1B P04054 1/20 0.46
ATG4B Q9Y4P1 1/20 0.46
KCNA5 P22460 1/20 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
SCHEMBL7066286 0.91 AKR1B1 (0.83) AKR1B1AKR1A1PTGDR2L3MBTL1AKR1B10
SCHEMBL7067029 0.90 AKR1B1 (0.82) AKR1B1AKR1A1PTGDR2AKR1B10KCNA5
SCHEMBL7063354 0.90 AKR1B1 (0.82) AKR1B1AKR1A1PTGDR2AKR1B10
SCHEMBL7063287 0.87 AKR1B1 (0.78) AKR1B1AKR1A1PTGDR2AKR1B10
SCHEMBL5459444 0.87 AKR1B1 (0.77) AKR1B1AKR1A1PTGDR2AKR1B10
SCHEMBL7062583 0.86 AKR1B1 (0.77) AKR1B1AKR1A1PTGDR2AKR1B10
SCHEMBL5462608 0.86 AKR1B1 (0.75) AKR1B1AKR1A1PTGDR2L3MBTL1AKR1B10
SCHEMBL5466266 0.86 AKR1B1 (1.00) AKR1B1AKR1A1PTGDR2MAPTLMNA
SCHEMBL7065285 0.86 AKR1B1 (0.84) AKR1B1AKR1A1PTGDR2MAPTAKR1B10
SCHEMBL7067035 0.86 AKR1B1 (0.75) AKR1B1AKR1A1PTGDR2AKR1B10

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 11 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
US-6420426-B1 USED TO TREAT COMPLICATIONS FROM DIABETES MELLITUS THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY LLC 2002-07-16 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 791/4885PTGDR2 281/4885
US-20030036558-A1 Substituted phenoxyacetic acids SLC5A2, GPR119, SLC5A1 AKR1B1 708/4885AKR1A1 791/4885PTGDR2 281/4885

“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.