SCHEMBL4481382

SCHEMBL4481382

Cc1oc(C=CC(C)(C)C)nc1CCOS(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.39
PTPN1 P18031 3/20 0.39
PPARA Q07869 3/20 0.31
PPARD Q03181 1/20 0.31
KDM4E B2RXH2 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MMP9 P14780 1/20 0.30
ALOX15 P16050 1/20 0.30
TSHR P16473 1/20 0.30

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
SCHEMBL4481381 1.00 PPARG (0.39) PPARGPTPN1PPARAPPARDKDM4E
SCHEMBL4479563 0.88 PTPN1 (0.41) PPARGPTPN1
SCHEMBL4479567 0.88 PTPN1 (0.41) PPARGPTPN1
SCHEMBL4477988 0.84 PTPN1 (0.40) PPARGPTPN1PPARA
SCHEMBL4477990 0.84 PTPN1 (0.40) PPARGPTPN1PPARA
SCHEMBL4491657 0.80
SCHEMBL4491659 0.80
SCHEMBL3292591 0.80 PTPN1 (0.38) PPARGPTPN1PPARA
SCHEMBL3292593 0.80 PTPN1 (0.38) PPARGPTPN1PPARA
SCHEMBL4471599 0.79 PPARG (0.39) PPARGPTPN1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7557123-B2 Heterocyclic compound and medicinal use thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2009-07-07 US disclosed
US-20040220215-A1 Novel heterocyclic compound and medicinal use thereof KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 2004-11-04 US disclosed
EP-1403253-A1 NOVEL HETEROCYCLIC COMPOUND AND MEDICINAL USE THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 2004-03-31 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-20040220215-A1 Novel heterocyclic compound and medicinal use thereof GPR119, INSR, GLP1R PPARG 6/4885PTPN1 750/4885PPARA 7/4885

“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.