SCHEMBL4876799

SCHEMBL4876799

CC(=O)Nc1nc(CCc2ccc(NC(NC(=O)O)NC(=O)O)cc2)c(C(=O)NCc2ccc(C(F)(F)F)cc2)s1

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.47
PPARG P37231 5/20 0.44
PPARD Q03181 3/20 0.44
CHRM4 P08173 1/20 0.41
SCD O00767 1/20 0.38
FFAR1 O14842 2/20 0.38
EPHX2 P34913 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
DYRK1A Q13627 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
SCHEMBL4873575 0.91 SCD (0.40) CHRM4SCD
SCHEMBL4992515 0.91 SCD (0.48) CHRM4SCD
SCHEMBL4986379 0.90 PPARA (0.53) PPARAPPARGPPARDCHRM4SCD
SCHEMBL4874051 0.87 AOC3 (0.48) CHRM4SCD
SCHEMBL4873046 0.87 SCD (0.42) PPARAPPARGPPARDSCDFFAR1
SCHEMBL4869384 0.86 PPARA (0.43) PPARASCDDYRK1A
SCHEMBL4988041 0.85 PPARA (0.42) PPARAPPARGPPARDCHRM4EPHX2
SCHEMBL4875954 0.85 AOC3 (0.40)
SCHEMBL4876994 0.84 ALDH1A1 (0.48) CHRM4SCD
SCHEMBL4877704 0.84 CHRM4 (0.47) PPARAPPARGPPARDCHRM4EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608365-B1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE R TECH UENO LTD (JP) 2013-10-02 EP disclosed
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US disclosed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 US disclosed
US-7125901-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-10-24 US disclosed
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-12-23 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 (2 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-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 PPARA 1215/4885PPARG 1095/4885PPARD 1104/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB PPARA 2910/4885PPARG 3083/4885PPARD 3531/4885

“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.