SCHEMBL6034876

SCHEMBL6034876

CCCc1nn(-c2ccc(C(F)(F)F)cn2)cc1CCCOc1cc(CC(=O)O)ccc1F

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 13/20 0.40
NR1H3 Q13133 13/20 0.40
PPARD Q03181 13/20 0.40
PPARA Q07869 11/20 0.39
PPARG P37231 7/20 0.38
ROCK2 O75116 1/20 0.38
GCGR P47871 1/20 0.35

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
SCHEMBL6035524 0.91 PPARD (0.43) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6035430 0.91 PPARD (0.41) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6035664 0.91 PPARD (0.41) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6035112 0.89 PPARD (0.42) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6035712 0.88 PPARG (0.44) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6036423 0.87 PPARD (0.40) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6035959 0.86 PLA2G4B (0.42) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6034621 0.86 PPARG (0.39) NR1H2NR1H3PPARDPPARAPPARG
SCHEMBL6035863 0.85 PPARD (0.41) PPARDPPARAPPARG
SCHEMBL6034663 0.85 PPARG (0.44) NR1H2NR1H3PPARDPPARAPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-07-06 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 (1 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-20060148858-A1 1, 2-Azole derivatives with hypoglycemic and hypolipidemic activity GPR119, SLC5A1, CYP4B1 NR1H2 12/4885NR1H3 4/4885PPARD 2488/4885

“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.