SCHEMBL10705010

SCHEMBL10705010

COC(=O)[C@@H](C)N[C@@H](CC(C)(C)C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRN P28799 3/20 0.39
SORT1 Q99523 3/20 0.39
MME P08473 3/20 0.37
MEN1 O00255 1/20 0.37
TSHR P16473 1/20 0.37
KMT2A Q03164 1/20 0.37
CA14 Q9ULX7 2/20 0.37
TGFBR1 P36897 2/20 0.37
FOLH1 Q04609 3/20 0.36
CA12 O43570 1/20 0.35
MAPT P10636 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CTSL P07711 1/20 0.32
CTSB P07858 1/20 0.32
CTSS P25774 1/20 0.32
NAALAD2 Q9Y3Q0 2/20 0.32
ALDH1A1 P00352 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31

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
SCHEMBL10825051 0.85 MME (0.37) GRNSORT1MMEMEN1TSHR
SCHEMBL10705609 0.78 FOLH1 (0.51) GRNSORT1MMEMEN1KMT2A
SCHEMBL10705602 0.78 FOLH1 (0.51) GRNSORT1MMEMEN1KMT2A
SCHEMBL10705812 0.77 CTSS (0.51) MAPTL3MBTL1CTSLCTSBCTSS
SCHEMBL10825083 0.77 CTSS (0.51) MAPTL3MBTL1CTSLCTSBCTSS
SCHEMBL19543469 0.72 GRN (0.45) GRNSORT1MMEMEN1KMT2A
SCHEMBL7327447 0.72 CA14 (0.48) MMEMEN1TSHRKMT2ACA14
SCHEMBL7327452 0.72 CA14 (0.48) MMEMEN1TSHRKMT2ACA14
SCHEMBL10707195 0.71 MME (0.42) GRNSORT1MMECTSLACE
SCHEMBL6237821 0.71 CTSK (0.43) MMEMEN1KMT2ACTSSACE

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
EP-0126974-B1 CARBOXYALKYL PEPTIDE DERIVATIVES G.D. Searle & Co. (US) 1988-06-15 EP disclosed
US-4568666-A COLLAGENASE INHIBITORS, ANTIARTJRITIC AGENTS G. D. SEARLE & CO. (US) 1986-02-04 US disclosed
US-4511504-A COLLAGENASE INHIBITORS G.D. SEARLE & CO. (US) 1985-04-16 US disclosed
EP-0126974-A1 Carboxyalkyl peptide derivatives G.D. Searle & Co. (US) 1984-12-05 EP disclosed