SCHEMBL29611596

SCHEMBL29611596

CC(C)C[C@H](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 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CAPN1 P07384 8/20 0.57
CTSB P07858 3/20 0.49
STAT3 P40763 1/20 0.48
NMUR2 Q9GZQ4 4/20 0.46
NMUR1 Q9HB89 4/20 0.46
OPRD1 P41143 2/20 0.46
OPRM1 P35372 1/20 0.46
OPRK1 P41145 1/20 0.46
F2R P25116 2/20 0.45
NTSR2 O95665 1/20 0.45
NTSR1 P30989 1/20 0.45
SORT1 Q99523 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
SCHEMBL29611522 0.97 CAPN1 (0.54) CAPN1CTSBSTAT3OPRD1OPRM1
SCHEMBL29611806 0.95 CAPN1 (0.51) CAPN1NMUR2NMUR1OPRD1OPRM1
SCHEMBL29611351 0.95 CAPN1 (0.56) CAPN1CTSBSTAT3OPRD1OPRM1
SCHEMBL29611481 0.94 CAPN1 (0.51) CAPN1NMUR2NMUR1OPRD1OPRM1
SCHEMBL29611741 0.93 CAPN1 (0.56) CAPN1CTSBSTAT3NMUR2NMUR1
SCHEMBL29611589 0.93 CAPN1 (0.56) CAPN1CTSBSTAT3OPRD1OPRM1
SCHEMBL29611376 0.93 CAPN1 (0.54) CAPN1CTSBSTAT3NMUR2NMUR1
SCHEMBL29611754 0.93 CAPN1 (0.49) CAPN1OPRD1OPRM1OPRK1
SCHEMBL29611384 0.92 NMUR2 (0.51) CAPN1NMUR2NMUR1OPRD1OPRM1
SCHEMBL29611731 0.92 CAPN1 (0.55) CAPN1CTSBSTAT3NMUR2NMUR1

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 6 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
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
WO-2024038345-A1 COMPOUNDS USEFUL FOR THE TREATMENT AND/OR CARE OF THE SKIN, HAIR, NAILS AND/OR MUCOUS MEMBRANES LUBRIZOL ADVANCED MATERIALS, INC. (US) 2024-02-22 WO 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 4460/4885CTSB 4433/4885STAT3 3629/4885
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes TYR, TELO2, MTX2 CAPN1 4460/4885CTSB 4433/4885STAT3 3629/4885

“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.