SCHEMBL38665437

SCHEMBL38665437

CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)[C@@H](C)O

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CAPN1 P07384 4/20 0.54
▸ SLC6A2 P23975 1/20 0.53
▸ CTSB P07858 2/20 0.51
▸ CALCRL Q16602 2/20 0.51
▸ REN P00797 2/20 0.49
▸ RAMP3 O60896 1/20 0.49
▸ CALCR P30988 1/20 0.49
▸ KEAP1 Q14145 1/20 0.48
▸ KISS1R Q969F8 2/20 0.48
▸ F2 P00734 1/20 0.48
▸ NTSR1 P30989 1/20 0.48
▸ OPRM1 P35372 2/20 0.47
▸ OPRD1 P41143 2/20 0.47
▸ OPRK1 P41145 1/20 0.47

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
SCHEMBL30760717 0.92 REN (0.55) CAPN1SLC6A2RENNTSR1OPRM1
SCHEMBL29430201 0.86 F2 (0.57) CALCRLCALCRF2NTSR1OPRM1
SCHEMBL8625484 0.85 CAPN1 (0.54) CAPN1SLC6A2CTSBNTSR1
SCHEMBL31694455 0.85 SLC6A2 (0.58) SLC6A2RENF2OPRM1OPRD1
SCHEMBL1674814 0.85 OPRM1 (0.55) SLC6A2F2NTSR1OPRM1OPRD1
SCHEMBL22400261 0.85 OPRM1 (0.55) SLC6A2F2NTSR1OPRM1OPRD1
SCHEMBL1674810 0.85 OPRM1 (0.55) SLC6A2F2NTSR1OPRM1OPRD1
SCHEMBL29641795 0.85 CALCRL (0.60) SLC6A2CALCRLRENOPRM1OPRD1
SCHEMBL8625474 0.84 CAPN1 (0.53) CAPN1SLC6A2CTSBCALCRLRAMP3
SCHEMBL31182814 0.84 F2 (0.57) RENF2NTSR1

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
CN-122060057-A Clara cell protein antibody or antigen binding fragment and application thereof 天津博奥赛斯生物科技股份有限公司 2026-05-19 — — CN disclosed
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