SCHEMBL29612266

SCHEMBL29612266

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCC(=O)O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.60
▸ BACE1 P56817 12/20 0.55
▸ NTSR2 O95665 1/20 0.54
▸ NTSR1 P30989 1/20 0.54
▸ MDM4 O15151 1/20 0.52
▸ MDM2 Q00987 1/20 0.52
▸ CTSD P07339 2/20 0.51
▸ BACE2 Q9Y5Z0 2/20 0.51

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
SCHEMBL30788717 0.94 F2 (0.58) F2BACE1NTSR2NTSR1MDM4
SCHEMBL29373116 0.93 BACE1 (0.61) F2BACE1NTSR2NTSR1MDM4
SCHEMBL30517172 0.93 BACE1 (0.60) F2BACE1NTSR2NTSR1MDM4
SCHEMBL29611893 0.93 NTSR1 (0.61) F2BACE1NTSR2NTSR1BACE2
SCHEMBL30239118 0.91 BACE1 (0.55) F2BACE1NTSR2NTSR1CTSD
SCHEMBL30054245 0.90 F2 (0.58) F2BACE1NTSR2NTSR1MDM4
SCHEMBL30054333 0.90 F2 (0.57) F2BACE1NTSR2NTSR1MDM4
SCHEMBL30423322 0.90 ACE (0.56) F2BACE1NTSR2NTSR1CTSD
SCHEMBL29379622 0.90 BACE1 (0.62) BACE1CTSDBACE2
SCHEMBL29603718 0.90 BACE1 (0.62) BACE1CTSDBACE2

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 F2 967/4885BACE1 3288/4885NTSR2 2257/4885
US-12419824-B2 Compounds useful for the treatment and/or care of the skin, hair, nails and/or mucous membranes TYR, TELO2, MTX2 F2 967/4885BACE1 3288/4885NTSR2 2257/4885

“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.

Send feedback