SCHEMBL31721895

SCHEMBL31721895

CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O)[C@@H](C)O)C(C)C)[C@@H](C)O

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CALCRL Q16602 4/20 0.53
▸ RAMP3 O60896 3/20 0.50
▸ CALCR P30988 3/20 0.50
▸ OPRM1 P35372 3/20 0.49
▸ OPRD1 P41143 3/20 0.49
▸ OPRK1 P41145 3/20 0.49
▸ CAPN1 P07384 2/20 0.49
▸ EP300 Q09472 1/20 0.49
▸ HIF1A Q16665 1/20 0.49
▸ CRHR1 P34998 1/20 0.48
▸ CRHR2 Q13324 1/20 0.48
▸ FCGRT P55899 1/20 0.48
▸ KEAP1 Q14145 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
SCHEMBL30695264 0.96 SLC6A2 (0.52) CALCRLRAMP3CALCROPRM1OPRD1
SCHEMBL30692047 0.88 NPY2R (0.58) CALCREP300HIF1A
SCHEMBL675630 0.84 CAPN1 (0.48) CALCRLRAMP3CALCRCAPN1FCGRT
SCHEMBL29845518 0.83 REN (0.59) —
SCHEMBL31332117 0.83 OPRD1 (0.58) CALCRLOPRM1OPRD1OPRK1
SCHEMBL31130613 0.82 CALCR (0.56) RAMP3CALCROPRM1OPRD1OPRK1
SCHEMBL30607299 0.82 CALCR (0.57) CALCROPRM1OPRD1EP300HIF1A
SCHEMBL29453068 0.81 SLC6A2 (0.67) CALCRL
SCHEMBL30428845 0.81 OPRM1 (0.63) RAMP3CALCROPRM1OPRD1OPRK1
SCHEMBL31182741 0.81 CALCR (0.62) RAMP3CALCREP300HIF1A

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
WO-2025229200-A1 MANUFACTURE OF DISULFIDE BONDED PEPTIDES BACHEM HOLDING AG (CH) 2025-11-06 — — WO disclosed
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