SCHEMBL10214909

SCHEMBL10214909

CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)c(C=O)c1)C(=O)OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.50
TACR1 P25103 1/20 0.48
ACE P12821 1/20 0.47
CTSS P25774 4/20 0.46
CTSB P07858 3/20 0.46
CTSK P43235 3/20 0.46
KLK5 Q9Y337 1/20 0.46
CTSL P07711 1/20 0.46
PTPN1 P18031 3/20 0.46
BCL2 P10415 1/20 0.46
MAPT P10636 2/20 0.46
KDM4E B2RXH2 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
POLB P06746 1/20 0.46
MAPK1 P28482 1/20 0.46
PPARG P37231 1/20 0.45
YAP1 P46937 1/20 0.44

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
SCHEMBL2617286 1.00 PPARA (0.50) PPARATACR1ACECTSSCTSB
SCHEMBL9589336 0.89 PPARA (0.52) PPARATACR1ACECTSSCTSB
SCHEMBL9589331 0.89 PPARA (0.52) PPARATACR1ACECTSSCTSB
SCHEMBL15616903 0.88 PPARA (0.52) PPARATACR1ACECTSSCTSB
SCHEMBL15616904 0.88 PPARA (0.46) PPARATACR1ACECTSSCTSB
SCHEMBL2617294 0.87 TACR1 (0.44) PPARATACR1ACECTSSCTSB
SCHEMBL13707871 0.87 TACR1 (0.44) PPARATACR1ACECTSSCTSB
SCHEMBL13626933 0.87 TACR1 (0.52) PPARATACR1ACECTSSCTSB
SCHEMBL10214908 0.86 PTPN1 (0.58) PPARATACR1ACECTSSCTSB
SCHEMBL2617284 0.86 PTPN1 (0.58) PPARATACR1ACECTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8207340-B2 Imidazopyridinyl benzamide mitotic kinesin inhibitors CYTOKINETICS, INCORPORATED (US) 2012-06-26 US disclosed
US-20090312365-A1 Certain Chemical Entities, Compositions, and Methods CYTOKINETICS, INC. 2009-12-17 US disclosed
US-7582668-B2 Imidazoyl-benzamide anti-cancer agents CYTOKINETICS, INCORPORATED (US) 2009-09-01 US disclosed
US-20070149516-A1 Certain chemical entities, compositions, and methods CYTOKINETICS, INCORPORATED 2007-06-28 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-20090312365-A1 Certain Chemical Entities, Compositions, and Methods KIF5B, KIF2C, PLK1 PPARA 2973/4885TACR1 4183/4885ACE 4363/4885
US-20070149516-A1 Certain chemical entities, compositions, and methods KIF5B, KIF2C, PLK1 PPARA 2973/4885TACR1 4183/4885ACE 4363/4885

“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.