SCHEMBL38664798

SCHEMBL38664798

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CS)C(C)C)C(C)C)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)O)C(C)C

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ AGTR2 P50052 3/20 0.57
▸ AGTR1 P30556 2/20 0.57
▸ CALCR P30988 4/20 0.57
▸ OPRD1 P41143 3/20 0.53
▸ KDM1A O60341 1/20 0.52
▸ OPRM1 P35372 1/20 0.52
▸ OPRK1 P41145 1/20 0.52
▸ NTSR2 O95665 3/20 0.52
▸ NTSR1 P30989 3/20 0.52
▸ SORT1 Q99523 2/20 0.52
▸ F2 P00734 1/20 0.52
▸ NPY1R P25929 1/20 0.51
▸ NPY2R P49146 1/20 0.51
▸ NPY4R P50391 1/20 0.51
▸ NPY5R Q15761 1/20 0.51

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
SCHEMBL30824279 0.88 CALCR (0.55) CALCRKDM1ANPY1RNPY2RNPY4R
SCHEMBL29903379 0.88 NTSR2 (0.58) CALCROPRD1KDM1AOPRM1OPRK1
SCHEMBL30607345 0.88 CALCR (0.66) CALCRNPY1RNPY2RNPY4RNPY5R
SCHEMBL30512575 0.88 NPY2R (0.49) AGTR2AGTR1CALCRKDM1ANTSR2
SCHEMBL30804676 0.87 NPY2R (0.63) KDM1ANPY1RNPY2RNPY4RNPY5R
SCHEMBL30431861 0.86 NTSR1 (0.61) KDM1ANTSR2NTSR1SORT1F2
SCHEMBL30432215 0.86 CALCR (0.57) CALCROPRD1OPRM1OPRK1NTSR2
SCHEMBL31232418 0.86 OPRD1 (0.59) AGTR2AGTR1CALCROPRD1KDM1A
SCHEMBL30844247 0.85 NPY2R (0.47) AGTR2AGTR1KDM1AOPRM1NTSR2
SCHEMBL29676363 0.85 NTSR1 (0.57) AGTR2AGTR1OPRD1OPRM1OPRK1

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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