SCHEMBL29327616

SCHEMBL29327616

Cc1cccc(-c2nc3cc(NC(=O)c4nc(C#N)ccc4S(C)(=O)=O)ccc3o2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 4/20 0.56
▸ HPGD P15428 3/20 0.56
▸ KDM4E B2RXH2 3/20 0.56
▸ NPC1 O15118 3/20 0.56
▸ ALDH1A1 P00352 3/20 0.56
▸ RAB9A P51151 3/20 0.56
▸ SMN1; SMN2 Q16637 3/20 0.56
▸ HSD17B10 Q99714 2/20 0.56
▸ MAPT P10636 9/20 0.53
▸ THRB P10828 2/20 0.53
▸ LMNA P02545 2/20 0.51
▸ POLB P06746 2/20 0.51
▸ RXFP1 Q9HBX9 3/20 0.51
▸ PPARG P37231 1/20 0.51
▸ STAT3 P40763 1/20 0.50
▸ STAT1 P42224 1/20 0.50
▸ PTGS2 P35354 1/20 0.50
▸ PTPN2 P17706 1/20 0.47
▸ PTPN1 P18031 1/20 0.47
▸ PTPN5 P54829 1/20 0.47

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
SCHEMBL29327627 0.91 MAPT (0.57) TP53KDM4ENPC1ALDH1A1RAB9A
SCHEMBL29327620 0.91 TP53 (0.54) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327637 0.89 PPARG (0.52) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327624 0.85 MAPT (0.58) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327737 0.85 MAPT (0.56) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327577 0.85 MAPT (0.58) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327625 0.85 PPARG (0.60) TP53NPC1RAB9ASMN1; SMN2MAPT
SCHEMBL29327628 0.83 MAPT (0.59) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327633 0.83 PPARG (0.54) TP53HPGDKDM4ENPC1ALDH1A1
SCHEMBL29327646 0.82 PPARG (0.53) TP53KDM4ENPC1RAB9ASMN1; SMN2

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 TP53 1398/4885HPGD 320/4885KDM4E 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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