SCHEMBL29611896

SCHEMBL29611896

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

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 13/20 0.55
BACE2 Q9Y5Z0 4/20 0.55
NPY1R P25929 1/20 0.54
NPY2R P49146 1/20 0.54
NPY4R P50391 1/20 0.54
NTSR2 O95665 1/20 0.52
NTSR1 P30989 1/20 0.52
CTSD P07339 2/20 0.51
F2 P00734 1/20 0.49
NAALAD2 Q9Y3Q0 1/20 0.49
OPRD1 P41143 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
SCHEMBL29611448 0.94 BACE1 (0.56) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL30974007 0.93 ERAP2 (0.52) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL30586759 0.93 BACE1 (0.60) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL31706956 0.92 NAALAD2 (0.57) NPY1RNPY2RNPY4RNTSR2NTSR1
SCHEMBL29611893 0.92 NTSR1 (0.61) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL31307271 0.92 BACE1 (0.54) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL29611743 0.92 BACE1 (0.51) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL29611583 0.92 NPY1R (0.52) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL29611639 0.91 OPRD1 (0.57) BACE1BACE2NPY1RNPY2RNPY4R
SCHEMBL29414548 0.91 NPY4R (0.55) BACE1BACE2NPY1RNPY2RNPY4R

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 BACE1 3288/4885BACE2 3110/4885NPY1R 65/4885
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes TYR, TELO2, MTX2 BACE1 3288/4885BACE2 3110/4885NPY1R 65/4885

“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.