SCHEMBL6035664

SCHEMBL6035664

CCCc1nn(-c2ccc(C(F)(F)F)cn2)cc1CCCOc1cc(CC(=O)O)ccc1OCC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 15/20 0.41
NR1H2 P55055 6/20 0.41
NR1H3 Q13133 6/20 0.41
PPARA Q07869 14/20 0.40
PPARG P37231 2/20 0.40
TP53 P04637 2/20 0.38
MAPT P10636 1/20 0.38
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
MDM2 Q00987 1/20 0.38

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
SCHEMBL6036423 0.96 PPARD (0.40) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6035524 0.94 PPARD (0.43) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6035430 0.94 PPARD (0.41) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6035112 0.91 PPARD (0.42) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6034876 0.91 NR1H2 (0.40) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6035258 0.88 PPARD (0.40) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6035712 0.87 PPARG (0.44) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6036038 0.87 FFAR4 (0.45) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6036342 0.87 FFAR4 (0.45) PPARDNR1H2NR1H3PPARAPPARG
SCHEMBL6035233 0.86 PPARD (0.43) PPARDNR1H2NR1H3PPARATP53

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 PPARD 2488/4885NR1H2 12/4885NR1H3 4/4885

“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.