SCHEMBL28209795

SCHEMBL28209795

CC(=O)N(C(C)=O)[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
CHRM2 P08172 4/20 0.32
CHRM4 P08173 4/20 0.32
CHRM5 P08912 4/20 0.32
CHRM1 P11229 4/20 0.32
CHRM3 P20309 4/20 0.32
TSHR P16473 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
SCHEMBL28209796 1.00 TP53 (0.41) TP53CHRM2CHRM4CHRM5CHRM1
SCHEMBL196163 0.74 TP53 (0.45) TP53TSHR
SCHEMBL196164 0.74 TP53 (0.45) TP53TSHR
SCHEMBL23152027 0.74 TP53 (0.45) TP53TSHR
SCHEMBL7424097 0.74 TP53 (0.45) TP53TSHR
SCHEMBL5495984 0.73 SLC7A5 (0.39) TP53
SCHEMBL3379637 0.72 TP53 (0.43) TP53TSHR
SCHEMBL3379632 0.72 TP53 (0.43) TP53TSHR
SCHEMBL22383977 0.72 TP53 (0.43) TP53TSHR
SCHEMBL6631137 0.72 TP53 (0.43) TP53TSHR

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-108066364-A Synthetic camel organ extract, its preparation method and application 兰多夫·里姆施耐德 2018-05-25 CN disclosed