SCHEMBL29611474

SCHEMBL29611474

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](CO)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NTSR2 O95665 7/20 0.48
NTSR1 P30989 7/20 0.48
F2R P25116 2/20 0.48
CAPN1 P07384 2/20 0.48
SORT1 Q99523 3/20 0.47
NMUR2 Q9GZQ4 4/20 0.46
NMUR1 Q9HB89 4/20 0.46
OPRM1 P35372 1/20 0.46
NPY1R P25929 1/20 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
SCHEMBL29611815 0.95 NTSR1 (0.51) NTSR2NTSR1F2RSORT1NMUR2
SCHEMBL29611888 0.93 NTSR2 (0.47) NTSR2NTSR1SORT1NMUR2NMUR1
SCHEMBL29677036 0.93 OPRM1 (0.48) NTSR2NTSR1F2RCAPN1SORT1
SCHEMBL29611384 0.91 NMUR2 (0.51) CAPN1NMUR2NMUR1OPRM1
SCHEMBL29611806 0.91 CAPN1 (0.51) NTSR2NTSR1CAPN1SORT1NMUR2
SCHEMBL23639483 0.91 NTSR2 (0.49) NTSR2NTSR1F2RCAPN1SORT1
SCHEMBL29611526 0.90 APLNR (0.48) NTSR2NTSR1F2RCAPN1NMUR2
SCHEMBL29601866 0.90 OPRM1 (0.51) NTSR2NTSR1SORT1OPRM1
SCHEMBL29611596 0.88 CAPN1 (0.57) NTSR2NTSR1F2RCAPN1SORT1
SCHEMBL29611889 0.88 CAPN1 (0.48) NTSR2NTSR1CAPN1SORT1OPRM1

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 NTSR2 2257/4885NTSR1 2437/4885F2R 3989/4885
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes TYR, TELO2, MTX2 NTSR2 2257/4885NTSR1 2437/4885F2R 3989/4885

“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.