SCHEMBL29611728

SCHEMBL29611728

CC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(N)=O)C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
APLNR P35414 1/20 0.49
CAPN1 P07384 2/20 0.49
OPRM1 P35372 8/20 0.49
OPRK1 P41145 8/20 0.49
NMUR2 Q9GZQ4 3/20 0.48
NMUR1 Q9HB89 3/20 0.48
OPRD1 P41143 2/20 0.46
KISS1R Q969F8 2/20 0.46
NPY1R P25929 1/20 0.45

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
SCHEMBL29611731 0.95 CAPN1 (0.55) APLNRCAPN1OPRM1OPRK1NMUR2
SCHEMBL29611477 0.94 CAPN1 (0.54) APLNRCAPN1OPRM1OPRK1NMUR2
SCHEMBL29611576 0.93 CAPN1 (0.48) APLNRCAPN1OPRM1OPRK1OPRD1
SCHEMBL29611806 0.92 CAPN1 (0.51) CAPN1OPRM1OPRK1NMUR2NMUR1
SCHEMBL29611574 0.91 CAPN1 (0.50) CAPN1NMUR2NMUR1
SCHEMBL29611353 0.89 CAPN1 (0.48) CAPN1NMUR2NMUR1
SCHEMBL29612057 0.89 CAPN1 (0.47) APLNRCAPN1OPRM1OPRK1OPRD1
SCHEMBL29611522 0.88 CAPN1 (0.54) APLNRCAPN1OPRM1OPRK1OPRD1
SCHEMBL29611889 0.88 CAPN1 (0.48) CAPN1OPRM1OPRK1OPRD1
SCHEMBL30869182 0.88 CAPN1 (0.49) APLNRCAPN1OPRM1OPRK1OPRD1

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
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes LUBRIZOL ADVANCED MATERIALS, INC. (US) 2025-09-23 US claimed
US-20220183950-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES LUBRIZOL ADVANCED MATERIALS, INC. (US) 2022-06-16 US claimed
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes LUBRIZOL ADVANCED MATERIALS, INC. (US) 2025-09-23 US disclosed
US-20220183950-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES LUBRIZOL ADVANCED MATERIALS, INC. (US) 2022-06-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20220183950-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES TYR, TELO2, MTX2 APLNR 974/4885CAPN1 4460/4885OPRM1 1087/4885
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes TYR, TELO2, MTX2 APLNR 974/4885CAPN1 4460/4885OPRM1 1087/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.