SCHEMBL10585294

SCHEMBL10585294

CC(C)(C)OC(=O)N[C@@H](CC(=O)OCc1ccccc1)C(=O)OC(=O)[C@H](CC(=O)OCc1ccccc1)NC(=O)OC(C)(C)C

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KLK5 Q9Y337 2/20 0.65
▸ KLK7 P49862 1/20 0.65
▸ PPARA Q07869 3/20 0.57
▸ SYK P43405 1/20 0.54
▸ CTSS P25774 4/20 0.54
▸ CACNA1B Q00975 5/20 0.53
▸ CTSK P43235 4/20 0.52
▸ PPARG P37231 2/20 0.52
▸ CTSL P07711 1/20 0.52
▸ CTSB P07858 1/20 0.52
▸ ACE P12821 1/20 0.50
▸ MMP9 P14780 1/20 0.48
▸ ATM Q13315 1/20 0.48

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
SCHEMBL12585497 0.95 KLK5 (0.65) KLK5KLK7PPARASYKCTSS
SCHEMBL9943561 0.95 KLK5 (0.65) KLK5KLK7PPARASYKCTSS
SCHEMBL9943562 0.95 KLK5 (0.65) KLK5KLK7PPARASYKCTSS
SCHEMBL4370045 0.95 KLK5 (0.65) KLK5KLK7PPARASYKCTSS
SCHEMBL5870038 0.94 KLK5 (0.64) KLK5KLK7PPARASYKCTSS
SCHEMBL14300985 0.94 KLK5 (0.64) KLK5KLK7PPARASYKCTSS
SCHEMBL14300984 0.94 KLK5 (0.64) KLK5KLK7PPARASYKCTSS
SCHEMBL344670 0.92 PPARA (0.63) KLK5KLK7PPARASYKCTSS
SCHEMBL344669 0.92 PPARA (0.63) KLK5KLK7PPARASYKCTSS
SCHEMBL84710 0.92 PPARA (0.63) KLK5KLK7PPARASYKCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0318240-A2 Peptide, adsorbent, method for production thereof, and method for use thereof AGENCY OF INDUSTRIAL SCIENCE & TECHNOLOGY MINISTRY OF INTERNATIONAL TRADE & INDUSTRY (JP) 1989-05-31 — — EP disclosed
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