SCHEMBL28059879

SCHEMBL28059879

CC(=O)NC(C(=O)O)C(C(=O)C(C)N)c1c[nH]cn1.CC(=O)NC(C(=O)O)C(C(=O)C(C)N)c1c[nH]cn1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.30

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
SCHEMBL27768915 1.00 AKR1B1 (0.30) AKR1B1
SCHEMBL667476 0.88
SCHEMBL17627358 0.88
SCHEMBL6156936 0.87
SCHEMBL11133981 0.85
SCHEMBL28382213 0.83
SCHEMBL16054387 0.82 FAAH (0.39)
SCHEMBL5283576 0.82 SLC7A5 (0.33)
SCHEMBL679593 0.82 SLC7A5 (0.33)
SCHEMBL52161 0.82 SLC7A5 (0.33)

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
CN-105461632-B A kind of preparation method of N acetyl L carnosines 湖北泓肽生物科技有限公司 2018-01-09 CN disclosed
CN-105461632-A Preparing method for N-acetyl-L-carnosine HUBEI HUNTIDE BIOTECH CO LTD 2016-04-06 CN disclosed