SCHEMBL3379855

SCHEMBL3379855

Cc1[nH]c2c(F)cc(Cl)cc2c1CC(N)=O

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP2 P11137 1/20 0.47
SIRT1 Q96EB6 9/20 0.44
KDM4E B2RXH2 2/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 2/20 0.38
MAPT P10636 2/20 0.38
KMT2A Q03164 2/20 0.38
ANO1 Q5XXA6 1/20 0.36
ICMT O60725 1/20 0.36
SIRT2 Q8IXJ6 1/20 0.36
APOL1 O14791 1/20 0.36
KRAS P01116 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL3263047 0.85 MAPT (0.39) KDM4EMEN1GAAMAPTKMT2A
SCHEMBL3261013 0.83 SIRT1 (0.39) SIRT1KDM4EMEN1GAAMAPT
SCHEMBL3264690 0.81 AKR1C2 (0.47) KDM4EMEN1GAAMAPTKMT2A
SCHEMBL3382968 0.81 ICMT (0.38) MAP2KDM4EMEN1GAAMAPT
SCHEMBL3382173 0.80 SIRT1 (0.38) SIRT1KDM4EMEN1GAAMAPT
SCHEMBL3228500 0.79 KRAS (0.51) MAP2APOL1KRAS
SCHEMBL3636076 0.78 KDM4E (0.55) KDM4EMEN1GAAMAPTKMT2A
SCHEMBL3261669 0.78 KDM4E (0.44) SIRT1KDM4EMEN1GAAMAPT
SCHEMBL3639755 0.76 CYP1A2 (0.41) SIRT1KDM4EMEN1GAAMAPT
SCHEMBL3638375 0.75 CYP1A2 (0.45) SIRT1KDM4EMEN1GAAMAPT

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
EP-2149552-A1 5,6 substituted benzamide derivatives as modulators of EP2 receptors Bayer Schering Pharma AG (DE) 2010-02-03 EP claimed