SCHEMBL29611522

SCHEMBL29611522

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

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 6/20 0.54
APLNR P35414 1/20 0.48
OPRM1 P35372 8/20 0.47
OPRK1 P41145 8/20 0.47
CTSB P07858 1/20 0.47
STAT3 P40763 1/20 0.47
OPRD1 P41143 2/20 0.46

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
SCHEMBL29611596 0.97 CAPN1 (0.57) CAPN1OPRM1OPRK1CTSBSTAT3
SCHEMBL29611754 0.96 CAPN1 (0.49) CAPN1APLNROPRM1OPRK1OPRD1
SCHEMBL29611576 0.95 CAPN1 (0.48) CAPN1APLNROPRM1OPRK1OPRD1
SCHEMBL29611477 0.94 CAPN1 (0.54) CAPN1APLNROPRM1OPRK1CTSB
SCHEMBL29611481 0.94 CAPN1 (0.51) CAPN1APLNROPRM1OPRK1OPRD1
SCHEMBL29612057 0.94 CAPN1 (0.47) CAPN1APLNROPRM1OPRK1OPRD1
SCHEMBL29611731 0.93 CAPN1 (0.55) CAPN1APLNROPRM1OPRK1CTSB
SCHEMBL29611889 0.92 CAPN1 (0.48) CAPN1OPRM1OPRK1OPRD1
SCHEMBL29611351 0.92 CAPN1 (0.56) CAPN1OPRM1OPRK1CTSBSTAT3
SCHEMBL29611526 0.92 APLNR (0.48) CAPN1APLNROPRM1OPRK1

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-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 CAPN1 4460/4885APLNR 974/4885OPRM1 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 CAPN1 4460/4885APLNR 974/4885OPRM1 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.