SCHEMBL30445840

SCHEMBL30445840

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

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 1/20 0.54
BACE1 P56817 8/20 0.54
MME P08473 4/20 0.53
ACE P12821 3/20 0.53
CPA1 P15085 1/20 0.53
ACE2 Q9BYF1 1/20 0.53
BACE2 Q9Y5Z0 2/20 0.51
FOLH1 Q04609 1/20 0.51
CASP1 P29466 1/20 0.50
CASP3 P42574 1/20 0.49
CASP7 P55210 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
SCHEMBL30445563 1.00 OPRD1 (0.54) OPRD1BACE1MMEACECPA1
SCHEMBL217352 0.91 FOLH1 (0.60) OPRD1BACE1MMEACECPA1
SCHEMBL17305518 0.91 BACE1 (0.62) BACE1BACE2
SCHEMBL31206305 0.91 BACE1 (0.62) BACE1BACE2
SCHEMBL29665022 0.90 NAALAD2 (0.57) MMEACECPA1ACE2FOLH1
SCHEMBL7935661 0.90 NAALAD2 (0.57) MMEACECPA1ACE2FOLH1
SCHEMBL30641532 0.90 NPY1R (0.54) OPRD1BACE1BACE2
SCHEMBL30445509 0.89 MME (0.54) OPRD1MMEACECPA1ACE2
SCHEMBL31062503 0.89 OPRD1 (0.61) OPRD1BACE1BACE2CASP3CASP7
SCHEMBL30331349 0.89 OPRD1 (0.56) OPRD1BACE1MMEBACE2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4573103-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES Lubrizol Advanced Materials, Inc. (US) 2025-06-25 EP disclosed
CN-119569818-A Liquid phase preparation method of thymic pentapeptide 恒敬合创生物医药(浙江)有限公司 2025-03-07 CN disclosed
EP-4316460-A1 COSMETIC COMPOSITIONS COMPRISING A SYNERGIC MIX OF ACTIVE INGREDIENTS HAVING ANTIAGING ACTIVITY Unifarco S.p.A. (IT) 2024-02-07 EP disclosed
EP-4192843-A1 PEPTIDES ABLE TO BIND ANGIOTENSIN-CONVERTING ENZYME 2 (ACE2) AND MEDICAL USES THEREOF Ospedale Pediatrico Bambino Gesù (IT) 2023-06-14 EP disclosed