SCHEMBL7956857

SCHEMBL7956857

Bc1ccc2c(c1)/C(=N/C#N)CC1(CCC(C(C)(C)C)C1)O2

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ATM Q13315 3/20 0.43
L3MBTL1 Q9Y468 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
SCHEMBL2378168 0.87 ATM (0.43) ATML3MBTL1
SCHEMBL2378170 0.87 ATM (0.43) ATML3MBTL1
SCHEMBL7957954 0.87 ATM (0.40) ATML3MBTL1
SCHEMBL7949729 0.84 ATM (0.34) ATML3MBTL1
SCHEMBL2377110 0.74 ATM (0.40) ATML3MBTL1
SCHEMBL7971751 0.74 KDM4E (0.33) ATM
SCHEMBL2374713 0.72 ATM (0.34) ATML3MBTL1
SCHEMBL1822517 0.72 HSD11B1 (0.33) ATML3MBTL1
SCHEMBL2376478 0.72 HSD11B1 (0.33) ATML3MBTL1
SCHEMBL2374721 0.72 ATM (0.34) ATML3MBTL1

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-2010021680-A2 INHIBITORS OF BETA-SECRETASE VITAE PHARMACEUTICALS, INC. (US) 2010-02-25 WO disclosed