SCHEMBL3434683

SCHEMBL3434683

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

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 18/20 0.55
SRC P12931 1/20 0.46
ALDH1A1 P00352 1/20 0.45

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
SCHEMBL30480960 0.95 ENPEP (0.51) ENPEPSRCALDH1A1
SCHEMBL3422282 0.90 ENPEP (0.46) ENPEPALDH1A1
SCHEMBL3422273 0.90 ENPEP (0.46) ENPEPALDH1A1
SCHEMBL11886063 0.90 ENPEP (0.54) ENPEPSRCALDH1A1
SCHEMBL29400621 0.90 ENPEP (0.54) ENPEPSRCALDH1A1
SCHEMBL29458837 0.90 ENPEP (0.54) ENPEPSRCALDH1A1
SCHEMBL31181245 0.89 ENPEP (0.57) ENPEPALDH1A1
SCHEMBL9451653 0.88 ENPEP (0.52) ENPEPSRCALDH1A1
SCHEMBL9451658 0.88 ENPEP (0.52) ENPEPSRCALDH1A1
SCHEMBL30076058 0.88 ENPEP (0.58) ENPEP

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
WO-2010020825-A2 UROCORTIN 3 FRAGMENTS AND ANALOGS, THEIR PREPARATION AND USE AS ANTIDEPRESSIVE AND ANXIOLYTIC AGENTS Szegedi Tudományegyetem (HU) 2010-02-25 WO disclosed