SCHEMBL5031956

SCHEMBL5031956

COc1ccc(CC2(C(=O)O)CC2)cc1CNC(=O)c1sc(-c2ccc(C)cc2)nc1C

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.49
PPARD Q03181 5/20 0.44
PPARG P37231 3/20 0.44
NPC1 O15118 1/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.41
S1PR1 P21453 1/20 0.41

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
SCHEMBL5032867 0.86 PPARA (0.44) PPARAPPARDPPARGNPC1HPGD
SCHEMBL5031926 0.86 PPARA (0.44) PPARAPPARDPPARGNPC1HPGD
SCHEMBL3418656 0.84 KDM4E (0.58) PPARAPPARDPPARGNPC1HPGD
SCHEMBL3419218 0.82 PPARA (0.51) PPARAPPARDPPARGNPC1HPGD
SCHEMBL5034523 0.80 HPGD (0.46) PPARAPPARGNPC1HPGDMAPT
SCHEMBL5034526 0.80 PPARA (0.47) PPARAPPARDPPARGNPC1LMNA
SCHEMBL5034527 0.80 PPARA (0.47) PPARAPPARDPPARGNPC1LMNA
SCHEMBL3417120 0.80 PPARA (0.49) PPARAPPARDPPARGNPC1HPGD
SCHEMBL3415767 0.79 PPARA (0.60) PPARAPPARDPPARGNPC1HPGD
SCHEMBL13460823 0.79 PPARA (0.47) PPARAPPARDPPARGNPC1HPGD

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
US-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-7371777-B2 Cyclic compound and PPAR agonist EISAI CO., LTD. (JP) 2008-05-13 US disclosed
US-20050014833-A1 Cyclic compound and ppar agonist EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-01-20 US disclosed
EP-1452521-A1 CYCLIC COMPOUND AND PPAR AGONIST Eisai Co., Ltd. (JP) 2004-09-01 EP 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-20050014833-A1 Cyclic compound and ppar agonist PPARA, PPARG, PPARD PPARA 1/4885PPARD 3/4885PPARG 2/4885

“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.