SCHEMBL5012902

SCHEMBL5012902

CC1CN(c2c(C=O)cc(-c3nnc(C4COC(C)(C)O4)s3)c(F)c2F)C[C@H](C)O1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL5012901 1.00 KDM4E (0.31) KDM4EHTTALDH1A1MAPT
SCHEMBL5012900 1.00 KDM4E (0.31) KDM4EHTTALDH1A1MAPT
SCHEMBL5015574 0.84 KDM4E (0.31) KDM4EHTT
SCHEMBL5015570 0.84 KDM4E (0.31) KDM4EHTT
SCHEMBL5015568 0.84 KDM4E (0.31) KDM4EHTT
SCHEMBL5010975 0.83 KDM4E (0.33) KDM4EHTTALDH1A1
SCHEMBL5011042 0.80 KDM4E (0.34) KDM4EHTTALDH1A1
SCHEMBL5011046 0.80 KDM4E (0.34) KDM4EHTTALDH1A1
SCHEMBL5012158 0.80 KDM4E (0.34) KDM4EHTTALDH1A1
SCHEMBL5012744 0.78 KDM4E (0.33) KDM4EHTTALDH1A1

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-1888597-A2 ANTIBACTERIAL AGENTS Warner-Lambert Company LLC (US) 2008-02-20 EP disclosed
WO-2006120563-A2 ANTIBACTERIAL AGENTS WARNER-LAMBERT COMPANY LLC (US) 2006-11-16 WO disclosed