SCHEMBL30524342

SCHEMBL30524342

CC(C)C[C@H](N)C(=O)N[C@@H](CCC(=O)OC(C)(C)C)C(=O)NCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLO1 Q04760 1/20 0.42
CTSS P25774 4/20 0.42
CTSK P43235 4/20 0.42
CTSL P07711 2/20 0.42
CTSB P07858 1/20 0.42
PTGS1 P23219 1/20 0.39
GSTK1 Q9Y2Q3 1/20 0.39
EGFR P00533 1/20 0.39
CAPN1 P07384 1/20 0.38
REN P00797 1/20 0.35
FOLH1 Q04609 2/20 0.34
MAPT P10636 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
GAA P10253 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
PTGS2 P35354 1/20 0.33
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33

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
SCHEMBL31510082 0.87 FOLH1 (0.43) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL31614434 0.85 REN (0.39) GLO1CTSSCTSKCTSLCTSB
SCHEMBL29373691 0.85 GLO1 (0.49) GLO1PTGS1GSTK1EGFRFOLH1
SCHEMBL29485691 0.83 GLO1 (0.47) GLO1PTGS1GSTK1EGFRFOLH1
SCHEMBL29877850 0.82 FOLH1 (0.40) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL30740010 0.82 FOLH1 (0.40) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL30643160 0.81 CTSS (0.54) CTSSCTSKCTSLCTSBCAPN1
SCHEMBL30852949 0.81 GLO1 (0.40) GLO1CTSSCTSKCTSLCTSB
SCHEMBL30814919 0.80 PTGS1 (0.39) GLO1CTSSCTSKCTSLCTSB
SCHEMBL30277398 0.80 FOLH1 (0.43) CTSSCTSKCTSLCTSBCAPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116693653-B Preparation method for large-scale production of somalupeptide 杭州湃肽生化科技有限公司 2023-10-31 CN disclosed
CN-116693653-A Preparation method for large-scale production of somalupeptide 杭州湃肽生化科技有限公司 2023-09-05 CN disclosed