SCHEMBL6334499

SCHEMBL6334499

CC(C)(Sc1ccc(-c2nc(C(=O)Nc3ccc(C(F)(F)F)cc3)c(-c3ccc(Cl)cc3)s2)cc1)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 4/20 0.47
▸ XDH P47989 1/20 0.44
▸ MAPT P10636 5/20 0.42
▸ AHR P35869 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ NR1H4 Q96RI1 1/20 0.40
▸ PTGDR2 Q9Y5Y4 1/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ PPARG P37231 2/20 0.39
▸ PPARD Q03181 1/20 0.39
▸ TRPV1 Q8NER1 1/20 0.39
▸ SLC22A12 Q96S37 1/20 0.38
▸ CNR2 P34972 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ USP36 Q9P275 1/20 0.38
▸ STAT3 P40763 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
SCHEMBL6326299 0.94 XDH (0.47) PPARAXDHMAPTLMNAMEN1
SCHEMBL6335252 0.92 PPARA (0.49) PPARAMAPTAHRLMNAMAPK1
SCHEMBL6334770 0.91 XDH (0.43) PPARAXDHMAPTPPARGPPARD
SCHEMBL6328143 0.91 PPARG (0.47) PPARAXDHMAPTMEN1KMT2A
SCHEMBL6335297 0.90 XDH (0.46) PPARAXDHMAPTLMNAPTGDR2
SCHEMBL6327984 0.90 PPARA (0.54) PPARAMAPTNR1H4MEN1KMT2A
SCHEMBL6335247 0.88 PPARA (0.43) PPARAXDHMAPTLMNAMEN1
SCHEMBL6328035 0.88 ALOX5 (0.47) PPARAXDHMAPTLMNAPTGDR2
SCHEMBL6327399 0.88 ALOX5 (0.47) PPARAXDHMAPTLMNAPTGDR2
SCHEMBL6336404 0.86 MAPT (0.42) PPARAXDHMAPTLMNAMEN1

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-20050014805-A1 Phenyl substituted 5-membered nitrogen containing heterocycles for the treatment of obesity BAYER PHARMACEUTICALS CORPORATION 2005-01-20 — — 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-20050014805-A1 Phenyl substituted 5-membered nitrogen containing heterocycles for the treatment of obesity GPR119, EGLN3, PC PPARA 49/4885XDH 1492/4885MAPT 3022/4885

“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.

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