SCHEMBL2098293

SCHEMBL2098293

Cc1c(-c2nc3c(F)c(F)cc(F)c3s2)c2cc(Oc3ccccc3)ccc2n1CC(=O)O

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 14/20 0.60
AKR1A1 P14550 13/20 0.60
PTGDR2 Q9Y5Y4 6/20 0.44

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
SCHEMBL2101752 0.90 AKR1B1 (0.59) AKR1B1AKR1A1PTGDR2
SCHEMBL7754895 0.89 AKR1B1 (0.61) AKR1B1AKR1A1PTGDR2
SCHEMBL7754413 0.88 AKR1A1 (0.59) AKR1B1AKR1A1PTGDR2
SCHEMBL2098715 0.88 AKR1B1 (0.70) AKR1B1AKR1A1PTGDR2
Water SCHEMBL5501664 0.87 AKR1B1 (0.69) AKR1B1AKR1A1PTGDR2
SCHEMBL7951912 0.87 AKR1A1 (0.60) AKR1B1AKR1A1PTGDR2
SCHEMBL7517303 0.86 AKR1B1 (0.61) AKR1B1AKR1A1PTGDR2
SCHEMBL7755683 0.84 AKR1A1 (0.58) AKR1B1AKR1A1PTGDR2
SCHEMBL2098560 0.84 AKR1B1 (0.58) AKR1B1AKR1A1PTGDR2
SCHEMBL7188436 0.82 AKR1B1 (0.57) 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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001051489-A2 METHODS FOR LOWERING URIC ACID LEVELS THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY, LLC (US) 2001-07-19 WO claimed
US-8163932-B2 Substituted indolealkanoic acids ALINEA PHARMACEUTICALS, INC. (US) 2012-04-24 US disclosed
US-20100137301-A1 Substituted Indolealkanoic Acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, LLC 2010-06-03 US disclosed
US-6964980-B2 Method of reducing serum glucose and triglyceride levels and for inhibiting angiogenesis using substitute indolealkanoic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, INC. (US) 2005-11-15 US disclosed
US-20030216452-A1 Method of reducing serum glucose and triglyceride levels and for inhibiting angiogenesis using substitute indolealkanoic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, INC. 2003-11-20 US disclosed
US-6555568-B1 3-(4,5,7-trifluorobenzothiazol-2-yl)methyl-indole-N-acetic acid, ethyl ester for example; treating angiogenesis, hyperglycemia, hyperlipidemia and chronic complications arising from diabetes mellitus INSTITUTE FOR PHARMACEUTICAL DISCOVERY, L.L.C. 2003-04-29 US disclosed
US-6426344-B2 INDOLEALKANOIC ACID DERIVATIVES INHIBITS ALDOSE REDUCTASE AND USEFUL FOR TREATING CHRONIC COMPLICATION ASSOCIATED WITH DIABETES MELLITUS INCLUDING DIABETIC CATARACTS, RETINOPATHY, NEPHROPATHY AND NEUROPATHY THE INSTITUTES FOR PHARMACEUTICAL DISCOVERY LLC 2002-07-30 US disclosed
US-20010016661-A1 Substituted indolealkanoic acids THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY 2001-08-23 US disclosed
US-6214991-B1 3-(4,5,7-TRIFLUOROBENZOTHIAZOL-2-YL)METHYL-INDOLE-N-ACETIC ACID, ETHYL ESTER FOR EXAMPLE; TREATING COMPLICATIONS OF DIABETES MELLITUS, SUCH AS CATARACTS, RETINOPATHY, NEPHROPATHY, AND NEUROPATHY THE INSTITUTE FOR PHARMACEUTICAL DISCOVERY, INC. 2001-04-10 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 (3 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-20010016661-A1 Substituted indolealkanoic acids GPR119, AANAT, AADAT AKR1B1 419/4885AKR1A1 475/4885PTGDR2 349/4885
US-20030216452-A1 Method of reducing serum glucose and triglyceride levels and for inhibiting angiogenesis using substitute indolealkanoic acids LIPG, PNLIP, LIPA AKR1B1 475/4885AKR1A1 513/4885PTGDR2 617/4885
US-20100137301-A1 Substituted Indolealkanoic Acids GPR119, AANAT, AADAT AKR1B1 419/4885AKR1A1 475/4885PTGDR2 349/4885

“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.