SCHEMBL4972141

SCHEMBL4972141

CC(NC(=O)O)C(O)C1CCOC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 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
SCHEMBL4752805 0.90 SMN1; SMN2 (0.33)
SCHEMBL4973787 0.90 SMN1; SMN2 (0.33)
SCHEMBL4974662 0.89 CA12 (0.33)
SCHEMBL4972570 0.89 CA12 (0.33)
SCHEMBL14910149 0.80 EPHX2 (0.40)
SCHEMBL16164720 0.80 EPHX2 (0.40)
SCHEMBL15399305 0.80 EPHX2 (0.40)
SCHEMBL1439228 0.80 EPHX2 (0.40)
SCHEMBL14910147 0.80 EPHX2 (0.40)
SCHEMBL15562277 0.77 CA12 (0.41)

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
EP-1966139-A1 ASPARTIC PROTEASE INHIBITORS Vitae Pharmaceuticals, Inc. (US) 2008-09-10 EP disclosed
WO-2007070201-A1 ASPARTIC PROTEASE INHIBITORS VITAE PHARMACEUTICALS, INC. (US) 2007-06-21 WO disclosed