SCHEMBL30198105

SCHEMBL30198105

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@H](C(=O)N[C@H](C(N)=O)C(C)C)[C@@H](C)O

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 1/20 0.46
▸ CRHR1 P34998 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ OPRD1 P41143 7/20 0.46
▸ CALCRL Q16602 1/20 0.46
▸ GLP1R P43220 3/20 0.45
▸ OPRM1 P35372 5/20 0.45
▸ OPRK1 P41145 2/20 0.45
▸ BACE1 P56817 1/20 0.45
▸ BACE2 Q9Y5Z0 1/20 0.45

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
SCHEMBL9437223 0.86 GLP1R (0.50) KISS1RCRHR1CRHR2GLP1RBACE1
SCHEMBL31020877 0.86 ACE (0.47) KISS1ROPRD1
SCHEMBL29381722 0.85 AGTR2 (0.50) OPRD1BACE1BACE2
SCHEMBL29450325 0.84 OPRM1 (0.53) KISS1ROPRD1GLP1ROPRM1OPRK1
SCHEMBL31199054 0.83 OPRD1 (0.44) OPRD1OPRM1OPRK1
SCHEMBL30274819 0.82 OPRD1 (0.51) OPRD1GLP1ROPRM1OPRK1
SCHEMBL31063872 0.82 OPRD1 (0.44) OPRD1OPRM1OPRK1BACE1
SCHEMBL15272522 0.81 OPRM1 (0.50) KISS1ROPRD1OPRM1
SCHEMBL15272531 0.81 OPRM1 (0.50) KISS1ROPRD1OPRM1
SCHEMBL16507827 0.81 ACE (0.49) KISS1R

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
US-20230021946-A1 MONOMERIC FUSION PEPTIDES AND METHOD OF USE THEREOF ALLYSTA PHARMACEUTICALS, INC. 2023-01-26 — — US disclosed
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