SCHEMBL29555036

SCHEMBL29555036

CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 5/20 0.41
▸ OPRK1 P41145 3/20 0.40
▸ TRHR P34981 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ APLNR P35414 1/20 0.40
▸ CAPN1 P07384 2/20 0.40
▸ F2R P25116 2/20 0.39
▸ F2 P00734 2/20 0.39
▸ MC4R P32245 1/20 0.39
▸ ACE2 Q9BYF1 4/20 0.39
▸ REN P00797 1/20 0.39

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
SCHEMBL29925778 0.96 ACE (0.43) ACEOPRK1TRHRMEN1KMT2A
SCHEMBL29590547 0.90 OPRK1 (0.46) ACEOPRK1TRHRMEN1KMT2A
SCHEMBL29630560 0.90 OPRK1 (0.46) ACEOPRK1TRHRMEN1KMT2A
SCHEMBL29630369 0.90 TRHR (0.41) ACETRHRF2RACE2
SCHEMBL30258236 0.89 F2 (0.45) OPRK1APLNRF2RF2MC4R
SCHEMBL30454445 0.88 CAPN1 (0.46) ACEOPRK1APLNRCAPN1F2
SCHEMBL29630670 0.88 TRHR (0.42) ACEOPRK1TRHRACE2
SCHEMBL29555153 0.87 F2 (0.46) APLNRF2REN
SCHEMBL29630596 0.87 MEN1 (0.43) ACEOPRK1TRHRMEN1KMT2A
SCHEMBL29630457 0.86 MC4R (0.42) TRHRF2MC4RREN

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
CN-109789180-B KIF 13B-derived peptides and methods of inhibiting angiogenesis 伊利诺伊大学理事会 2023-09-08 — — CN disclosed
US-11299524-B2 KIF13B-derived peptide and method of inhibiting angiogenesis THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS (US) 2022-04-12 — — US disclosed
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