SCHEMBL29327828

SCHEMBL29327828

COc1ccc(-c2nc3cc(NC(=O)c4cc(C#N)cnc4S(C)(=O)=O)ccc3o2)cc1F

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.56
▸ MAPT P10636 4/20 0.53
▸ KDM4E B2RXH2 2/20 0.53
▸ ALDH1A1 P00352 2/20 0.53
▸ HPGD P15428 2/20 0.53
▸ HSD17B10 Q99714 2/20 0.53
▸ NPC1 O15118 1/20 0.53
▸ RAB9A P51151 1/20 0.53
▸ TP53 P04637 3/20 0.52
▸ RXFP1 Q9HBX9 3/20 0.52
▸ PTGS2 P35354 10/20 0.52
▸ THRB P10828 1/20 0.51
▸ MAPK1 P28482 1/20 0.49

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
SCHEMBL29327593 0.88 TP53 (0.58) PPARGMAPTKDM4EALDH1A1HPGD
SCHEMBL29327807 0.86 PPARG (0.56) PPARGMAPTKDM4EALDH1A1HPGD
SCHEMBL29327754 0.85 PPARG (0.56) PPARGMAPTKDM4EALDH1A1HPGD
SCHEMBL29327696 0.84 TP53 (0.56) PPARGMAPTKDM4EALDH1A1HPGD
SCHEMBL29327818 0.83 PPARG (0.70) PPARGMAPTNPC1RAB9ATP53
SCHEMBL29327801 0.83 MAPT (0.56) PPARGMAPTKDM4EALDH1A1HPGD
SCHEMBL29327820 0.83 MAPT (0.55) PPARGMAPTKDM4EALDH1A1HPGD
SCHEMBL29327840 0.82 PPARG (0.57) PPARGMAPTKDM4ETP53RXFP1
SCHEMBL29327833 0.82 PPARG (0.55) PPARGMAPTKDM4EALDH1A1HSD17B10
SCHEMBL29327815 0.80 MAPT (0.57) PPARGMAPTKDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239760-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. 2024-07-18 — — US disclosed
US-20240239760-A1 PPARG INVERSE AGONISTS AND USES THEREOF FLARE THERAPEUTICS INC. 2024-07-18 — — 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-20240239760-A1 PPARG INVERSE AGONISTS AND USES THEREOF PPARG, PPARA, PPARD PPARG 1/4885MAPT 4591/4885KDM4E 4237/4885

“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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