SCHEMBL5356158

SCHEMBL5356158

COc1ccc(CNC(=O)[C@H](CS)NC(=O)OC(C)(C)C)cc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.53
LMNA P02545 1/20 0.53
PPARG P37231 1/20 0.52
PPARA Q07869 1/20 0.52
CACNA1B Q00975 2/20 0.49
CTSS P25774 8/20 0.47
CTSK P43235 8/20 0.47
ANPEP P15144 1/20 0.47
CTSB P07858 2/20 0.46
CTSL P07711 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
NPC1 O15118 1/20 0.46
EPHX2 P34913 1/20 0.46
RAB9A P51151 1/20 0.46
NR1H4 Q96RI1 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45

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
SCHEMBL5363519 0.88 ALDH1A1 (0.53) ALDH1A1LMNAPPARGPPARACACNA1B
SCHEMBL5347327 0.87 PPARG (0.56) ALDH1A1LMNAPPARGPPARACACNA1B
SCHEMBL5347323 0.87 PPARG (0.56) ALDH1A1LMNAPPARGPPARACACNA1B
SCHEMBL7347593 0.86 CTSS (0.61) PPARGPPARACTSSCTSKCTSB
SCHEMBL18766807 0.85 CTSS (0.67) CTSSCTSKCTSBCTSL
SCHEMBL31036374 0.85 CTSK (0.62) ALDH1A1LMNAPPARGPPARACACNA1B
SCHEMBL5353573 0.85 PPARG (0.69) ALDH1A1LMNAPPARGPPARACACNA1B
SCHEMBL18766806 0.85 CTSS (0.67) CTSSCTSKCTSBCTSL
SCHEMBL14591587 0.85 ALDH1A1 (0.51) ALDH1A1LMNAPPARGPPARACACNA1B
SCHEMBL7147567 0.84 ALDH1A1 (0.50) ALDH1A1LMNAPPARGPPARACACNA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7166590-B2 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-23 US disclosed
US-7166590-B2 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-23 US disclosed
US-7166590-B2 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. (JP) 2007-01-23 US disclosed
EP-0997147-B1 AMINO ACID DERIVATIVES ONO PHARMACEUTICAL CO (JP) 2006-03-15 EP disclosed
US-20030013725-A1 Amino acid derivatives ONO PHARMACEUTICAL CO., LTD. 2003-01-16 US disclosed
EP-0997147-A1 AMINO ACID DERIVATIVES Ono Pharmaceutical Co., Ltd. (JP) 2000-05-03 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-20030013725-A1 Amino acid derivatives CACNA1B, SCN1A, SCN2A ALDH1A1 3065/4885LMNA 2257/4885PPARG 4040/4885

“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.