SCHEMBL30956313

SCHEMBL30956313

CSCC[C@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CNC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CALCR P30988 3/20 0.50
▸ OPRM1 P35372 2/20 0.49
▸ OPRD1 P41143 2/20 0.49
▸ CRHR1 P34998 1/20 0.49
▸ CRHR2 Q13324 1/20 0.49
▸ F2 P00734 4/20 0.47
▸ GLP1R P43220 3/20 0.47
▸ SCTR P47872 1/20 0.47
▸ OPRL1 P41146 1/20 0.47
▸ KEAP1 Q14145 1/20 0.47
▸ CCKBR P32239 2/20 0.46

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
SCHEMBL30956314 1.00 CALCR (0.50) CALCROPRM1OPRD1CRHR1CRHR2
SCHEMBL29880253 0.91 CALCR (0.59) CALCRCRHR1CRHR2F2GLP1R
SCHEMBL31243560 0.90 CALCR (0.59) CALCRCRHR1CRHR2F2GLP1R
SCHEMBL29860251 0.88 OPRM1 (0.61) OPRM1OPRD1F2GLP1RSCTR
SCHEMBL30778184 0.88 CALCR (0.60) CALCRCRHR1CRHR2GLP1RSCTR
SCHEMBL29880436 0.88 CALCR (0.60) CALCRCRHR1CRHR2GLP1RSCTR
SCHEMBL29726691 0.88 CALCR (0.60) CALCRCRHR1CRHR2GLP1RSCTR
SCHEMBL31265506 0.87 CALCR (0.60) CALCRCRHR1CRHR2GLP1RSCTR
SCHEMBL30507402 0.87 OPRM1 (0.52) OPRM1OPRD1OPRL1KEAP1CCKBR
SCHEMBL30804653 0.87 CALCR (0.59) CALCRCRHR1CRHR2GLP1RSCTR

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
EP-4638730-A1 THERMOSTABLE SUBTILISIN VARIANTS AND THEIR USE Fresenius Kabi iPSUM S.r.l. (IT) 2025-10-29 — — EP disclosed
WO-2024133313-A1 THERMOSTABLE SUBTILISIN VARIANTS AND THEIR USE ENZYPEP B.V. (NL) 2024-06-27 — — WO disclosed
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