SCHEMBL29530953

SCHEMBL29530953

CC(C)C[C@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 7/20 0.57
▸ NPY1R P25929 5/20 0.57
▸ NPY2R P49146 3/20 0.57
▸ BACE1 P56817 3/20 0.51
▸ KISS1R Q969F8 6/20 0.51
▸ BACE2 Q9Y5Z0 1/20 0.51
▸ NPY5R Q15761 2/20 0.51
▸ IL1RN P18510 1/20 0.49
▸ ERAP2 Q6P179 1/20 0.49

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
SCHEMBL29531203 1.00 NPY4R (0.57) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL29403649 0.98 NPY4R (0.55) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL29531366 0.98 NPY4R (0.55) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL29530897 0.98 NPY4R (0.55) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL29531210 0.98 NPY4R (0.55) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL30184346 0.96 NPY4R (0.56) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL29496461 0.95 BACE1 (0.57) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL30558099 0.93 NPY1R (0.54) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL29730544 0.92 NPY4R (0.58) NPY4RNPY1RNPY2RBACE1KISS1R
SCHEMBL30184096 0.92 BACE1 (0.55) NPY4RNPY1RNPY2RBACE1BACE2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12312390-B2 Rapid-acting insulin analogues of enhanced stability CASE WESTERN RESERVE UNIVERSITY (US) 2025-05-27 — — US disclosed
US-20220112262-A1 RAPID-ACTING INSULIN ANALOGUES OF ENHANCED STABILITY CASE WESTERN RESERVE UNIVERSITY 2022-04-14 — — US disclosed
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