Sugi Predict

Sugi Predict / Compounds / SCHEMBL30429667

SCHEMBL30429667

SCHEMBL30429667

CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)CN)[C@@H](C)O)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ NMBR P28336 2/20 0.60
▸ GRPR P30550 2/20 0.60
▸ GALR2 O43603 2/20 0.60
▸ GALR1 P47211 2/20 0.60
▸ GLP1R P43220 8/20 0.57
▸ GCGR P47871 3/20 0.57
▸ CCKBR P32239 2/20 0.55
▸ C5AR1 P21730 1/20 0.55
▸ KISS1R Q969F8 2/20 0.54
▸ CALCA P06881 1/20 0.54
▸ F2 P00734 1/20 0.54
▸ NPY1R P25929 1/20 0.53
▸ NPY2R P49146 1/20 0.53
▸ NPY4R P50391 1/20 0.53
▸ NPY5R Q15761 1/20 0.53
▸ GIPR P48546 3/20 0.53

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
SCHEMBL30429251 0.93 CALCA (0.62) GALR2GALR1GLP1RCALCANPY1R
SCHEMBL30429448 0.91 GALR2 (0.62) GALR2GALR1GLP1RCCKBRKISS1R
SCHEMBL30523133 0.89 GLP1R (0.71) NMBRGRPRGLP1RGCGRCCKBR
SCHEMBL30932197 0.89 GLP1R (0.71) NMBRGRPRGLP1RGCGRCCKBR
SCHEMBL29973367 0.88 CXCL8 (0.62) NMBRGRPRGALR2GALR1GLP1R
Galanin SCHEMBL29352997 0.88 GLP1R (0.67) GLP1RGCGRCCKBRCALCANPY1R
Galantide SCHEMBL31332196 0.87 IL23R (0.62) NMBRGRPRGALR2GALR1GLP1R
SCHEMBL30148156 0.87 GRPR (0.59) NMBRGRPRGALR2GALR1GLP1R
SCHEMBL13613774 0.86 GALR2 (0.59) NMBRGRPRGALR2GALR1GLP1R
SCHEMBL31182577 0.86 GLP1R (0.71) NMBRGRPRGLP1RCCKBRNPY1R

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11986513-B2 GAL(1-15) and analogues thereof for use in the prevention and/or treatment of alcohol-related effects and disorders UNIVERSIDAD DE MÁLAGA (ES) 2024-05-21 — — US claimed
US-20230158115-A1 GAL(1-15) AND ANALOGUES THEREOF FOR USE IN THE PREVENTION AND/OR TREATMENT OF ALCOHOL-RELATED EFFECTS AND DISORDERS UNIVERSIDAD DE MÁLAGA (ES) 2023-05-25 — — US claimed
US-11986513-B2 GAL(1-15) and analogues thereof for use in the prevention and/or treatment of alcohol-related effects and disorders UNIVERSIDAD DE MÁLAGA (ES) 2024-05-21 — — US disclosed
US-11986513-B2 GAL(1-15) and analogues thereof for use in the prevention and/or treatment of alcohol-related effects and disorders UNIVERSIDAD DE MÁLAGA (ES) 2024-05-21 — — US disclosed
US-20230158115-A1 GAL(1-15) AND ANALOGUES THEREOF FOR USE IN THE PREVENTION AND/OR TREATMENT OF ALCOHOL-RELATED EFFECTS AND DISORDERS UNIVERSIDAD DE MÁLAGA (ES) 2023-05-25 — — US disclosed
US-20230158115-A1 GAL(1-15) AND ANALOGUES THEREOF FOR USE IN THE PREVENTION AND/OR TREATMENT OF ALCOHOL-RELATED EFFECTS AND DISORDERS UNIVERSIDAD DE MÁLAGA (ES) 2023-05-25 — — US disclosed
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