SCHEMBL30887565

SCHEMBL30887565

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

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 2/20 0.51
▸ GLP1R P43220 5/20 0.50
▸ VIPR1 P32241 3/20 0.50
▸ VIPR2 P41587 5/20 0.49
▸ BACE1 P56817 1/20 0.49
▸ F2 P00734 2/20 0.47
▸ PTH1R Q03431 1/20 0.47
▸ KLK7 P49862 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
SCHEMBL30415618 0.91 VIPR1 (0.53) KISS1RGLP1RVIPR1VIPR2PTH1R
SCHEMBL30648465 0.90 GLP1R (0.47) GLP1RVIPR1VIPR2BACE1
SCHEMBL30432103 0.90 VIPR1 (0.62) GLP1RVIPR1VIPR2PTH1R
SCHEMBL31366970 0.89 C5AR1 (0.49) GLP1RVIPR1VIPR2
SCHEMBL29461455 0.89 GLP1R (0.56) GLP1RVIPR1VIPR2
SCHEMBL30368368 0.88 GLP1R (0.42) GLP1RVIPR1VIPR2BACE1
SCHEMBL30956349 0.88 GLP1R (0.48) GLP1RVIPR1F2KLK7
SCHEMBL30974513 0.88 GLP1R (0.57) GLP1RPTH1R
SCHEMBL30956347 0.87 GLP1R (0.51) GLP1RVIPR1VIPR2BACE1
SCHEMBL31182598 0.86 VIPR1 (0.57) GLP1RVIPR1VIPR2PTH1R

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-117924471-A Antibodies or antigen binding fragments that specifically bind E2 proteins and uses thereof 杭州傲锐生物医药科技有限公司 2024-04-26 — — CN disclosed
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