SCHEMBL6035797

SCHEMBL6035797

CCCc1nn(-c2ccc(C(F)(F)F)cn2)cc1CCCCOc1ccccc1CC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 12/20 0.42
PPARA Q07869 6/20 0.42
PPARG P37231 5/20 0.42
LTB4R Q15722 1/20 0.40
LTB4R2 Q9NPC1 1/20 0.40
KDM4E B2RXH2 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
LIPE Q05469 2/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37

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
SCHEMBL6035863 0.97 PPARD (0.41) PPARDPPARAPPARGLTB4RLTB4R2
SCHEMBL6034987 0.93 PPARD (0.40) PPARDPPARAPPARGKDM4ELMNA
SCHEMBL6035923 0.90 SMN1; SMN2 (0.36) PPARDPPARAPPARGLTB4RLTB4R2
SCHEMBL6034680 0.90 LTB4R (0.44) PPARDPPARGLTB4RLTB4R2KDM4E
SCHEMBL6035208 0.90 HCRTR1 (0.38) PPARDPPARAPPARGLTB4RLTB4R2
SCHEMBL6034609 0.88 SMN1; SMN2 (0.43) PPARDPPARAPPARGKDM4ELMNA
SCHEMBL1633759 0.88 HCRTR1 (0.36) PPARDPPARAKDM4ELMNASMN1; SMN2
SCHEMBL6035752 0.87 SMN1; SMN2 (0.41) PPARDPPARAPPARGKDM4ELMNA
SCHEMBL6035540 0.87 PPARG (0.40) PPARDPPARAPPARGKDM4ELMNA
SCHEMBL6035210 0.86 GCGR (0.36) KDM4ELMNASMN1; SMN2PTGDR2LIPE

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 2488/4885PPARA 1717/4885PPARG 1037/4885

“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.