SCHEMBL30798183

SCHEMBL30798183

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

nearest known ligand 0.63

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 19/20 0.63
BACE2 Q9Y5Z0 6/20 0.63
CTSD P07339 3/20 0.56
OPRD1 P41143 1/20 0.53

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
SCHEMBL30798145 0.95 BACE1 (0.66) BACE1BACE2CTSDOPRD1
SCHEMBL30352879 0.93 BACE1 (0.65) BACE1BACE2CTSD
SCHEMBL30352847 0.93 BACE1 (0.65) BACE1BACE2CTSD
SCHEMBL30798078 0.91 OPRD1 (0.59) BACE1BACE2CTSDOPRD1
SCHEMBL30797994 0.91 BACE1 (0.62) BACE1BACE2CTSD
SCHEMBL30122869 0.87 OPRM1 (0.53) BACE1BACE2CTSDOPRD1
SCHEMBL30123009 0.87 NAALAD2 (0.61) BACE1BACE2
SCHEMBL31482982 0.87 NPY4R (0.57) OPRD1
SCHEMBL30974006 0.87 BACE1 (0.65) BACE1BACE2CTSDOPRD1
SCHEMBL31696295 0.86 BACE1 (0.61) BACE1BACE2CTSD

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-113832213-B Mycoplasma detection culture medium and preparation method thereof 北京兴德通医药科技股份有限公司 2024-03-12 CN disclosed