SCHEMBL10795035

SCHEMBL10795035

CCOC(=O)CN(C(=O)[C@H](C)NC(=O)OCc1ccccc1)C1CCCC1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CTSK P43235 6/20 0.50
CTSL P07711 2/20 0.50
CTSB P07858 2/20 0.50
CTSS P25774 2/20 0.50
MEN1 O00255 1/20 0.48
LMNA P02545 1/20 0.48
KMT2A Q03164 1/20 0.48
CYP1A2 P05177 1/20 0.48
PREP P48147 2/20 0.47
ELANE P08246 1/20 0.46
TP53 P04637 2/20 0.44
CYP3A4 P08684 2/20 0.43
TSHR P16473 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
LGMN Q99538 1/20 0.43
MAPT P10636 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
CCR5 P51681 1/20 0.42

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
SCHEMBL11130209 0.99 CTSK (0.49) CTSKCTSLCTSBCTSSMEN1
SCHEMBL10487578 0.95 CTSK (0.53) CTSKCTSLCTSBCTSSMEN1
SCHEMBL7331321 0.90 ELANE (0.56) CTSKCTSLCTSBCTSSELANE
SCHEMBL10790451 0.89 CTSK (0.54) CTSKCTSLCTSBCTSSMEN1
SCHEMBL7332393 0.89 ELANE (0.56) CTSKCTSLCTSBCTSSELANE
SCHEMBL10658214 0.89 CTSK (0.53) CTSKCTSLCTSBCTSSMEN1
SCHEMBL9002738 0.83 CASP1 (0.53)
SCHEMBL18359408 0.80 MEN1 (0.58) CTSKCTSLCTSBCTSSMEN1
SCHEMBL10487573 0.80 MEN1 (0.58) CTSKCTSLCTSBCTSSMEN1
SCHEMBL7323530 0.79 ELANE (0.69) CTSKCTSLCTSBCTSSMEN1

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
EP-0092942-B1 PEPTIDE DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1987-09-09 EP disclosed
US-4472383-A HYPOTENSIVE AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1984-09-18 US disclosed
EP-0057998-B1 ALICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1984-08-08 EP disclosed
EP-0092942-A2 Peptide derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-11-02 EP disclosed
EP-0057998-A1 Alicyclic compounds, their production and use Takeda Chemical Industries, Ltd. (JP) 1982-08-18 EP disclosed