SCHEMBL3220169

SCHEMBL3220169

CCCCOc1cc(C(=O)O)n(Cc2ccc(C(F)(F)F)cc2Cl)n1

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.49
NPC1 O15118 1/20 0.47
PTGDR2 Q9Y5Y4 2/20 0.42
MRGPRX4 Q96LA9 2/20 0.40
PPARD Q03181 2/20 0.40
PPARA Q07869 1/20 0.39
FAAH O00519 1/20 0.39

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
SCHEMBL3217543 0.90 PPARG (0.52) PPARGPTGDR2MRGPRX4
SCHEMBL3217357 0.88 NPC1 (0.49) PPARGNPC1PTGDR2MRGPRX4FAAH
SCHEMBL3195538 0.87 PPARG (0.48) PPARGNPC1PTGDR2
SCHEMBL3215812 0.86 PTGDR2 (0.48) PPARGPTGDR2PPARDPPARA
SCHEMBL3211484 0.86 NPC1 (0.60) PPARGNPC1
SCHEMBL3207244 0.85 PPARG (0.60) PPARGPTGDR2PPARDPPARA
SCHEMBL3207231 0.85 PPARG (0.60) PPARGPTGDR2PPARDPPARA
SCHEMBL3218168 0.85 PPARG (0.60) PPARG
SCHEMBL27737185 0.83 PPARG (0.58) PPARG
SCHEMBL3207559 0.83 PPARG (0.53) PPARGPTGDR2PPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100041892-A1 Therapeutic agent for diabetes ABE HIDENORI 2010-02-18 US disclosed
US-20090270631-A1 Therapeutic agent for diabetes ABE HIDENORI 2009-10-29 US disclosed
CN-101282725-A Therapeutic agent for diabetes TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2008-10-08 CN disclosed
EP-1912645-A2 THERAPEUTIC AGENT FOR DIABETES Takeda Pharmaceutical Company Limited (JP) 2008-04-23 EP disclosed
US-20080009530-A1 Therapeutic Agent for Diabetes TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-01-10 US disclosed
WO-2007018314-A2 THERAPEUTIC AGENT FOR DIABETES TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-02-15 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 (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-20090270631-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PPARG 31/4885NPC1 1683/4885PTGDR2 1289/4885
US-20080009530-A1 Therapeutic Agent for Diabetes FABP4, SLC5A1, SLC5A2 PPARG 30/4885NPC1 1377/4885PTGDR2 1005/4885
US-20100041892-A1 Therapeutic agent for diabetes FABP4, SLC5A1, SLC5A2 PPARG 31/4885NPC1 1683/4885PTGDR2 1289/4885

“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.