SCHEMBL30745233

SCHEMBL30745233

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

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IL1RN P18510 1/20 0.59
ERAP2 Q6P179 1/20 0.59
NPY4R P50391 4/20 0.59
NPY1R P25929 3/20 0.59
NPY2R P49146 3/20 0.59
NAALAD2 Q9Y3Q0 1/20 0.58
FOLH1 Q04609 1/20 0.55
BACE1 P56817 7/20 0.54
BACE2 Q9Y5Z0 3/20 0.54
OPRD1 P41143 3/20 0.52
OPRM1 P35372 1/20 0.52
NPY5R Q15761 2/20 0.52

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
SCHEMBL31711368 0.97 BACE1 (0.58) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL29531691 0.96 NPY4R (0.59) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL30473782 0.95 NPY4R (0.59) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL8329224 0.93 BACE1 (0.58) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL8329221 0.93 BACE1 (0.58) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL30317543 0.92 NPY4R (0.60) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL30844216 0.91 NPY4R (0.67) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL30123009 0.91 NAALAD2 (0.61) IL1RNERAP2NPY4RNPY1RNPY2R
SCHEMBL27780591 0.91 LTA4H (0.60) NAALAD2BACE1BACE2
SCHEMBL6378283 0.91 NAALAD2 (0.66) ERAP2NPY4RNPY1RNPY2RNAALAD2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117510583-A Testicular interstitial cell protective peptide and application thereof 广东省几何细胞生物科技有限公司 2024-02-06 CN disclosed