SCHEMBL29327701

SCHEMBL29327701

Cc1cncc(-c2nc3cc(NC(=O)c4cc(C#N)ccc4S(=O)(=O)C(F)(F)F)ccc3o2)c1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 3/20 0.55
▸ CETP P11597 7/20 0.51
▸ MAPT P10636 7/20 0.49
▸ TP53 P04637 2/20 0.47
▸ RXFP1 Q9HBX9 2/20 0.47
▸ KDM4E B2RXH2 2/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ POLB P06746 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43

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
SCHEMBL29327596 0.93 PPARG (0.57) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327677 0.91 PPARG (0.59) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327675 0.91 MAPT (0.55) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327687 0.86 PPARG (0.55) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327683 0.86 PPARG (0.72) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327681 0.85 MAPT (0.55) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327709 0.85 PPARG (0.58) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327833 0.84 PPARG (0.55) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327696 0.83 TP53 (0.56) PPARGCETPMAPTTP53RXFP1
SCHEMBL29327580 0.82 PPARG (0.62) PPARGCETPMAPTTP53RXFP1

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-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 1/4885CETP 715/4885MAPT 4591/4885

“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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