SCHEMBL5020144

SCHEMBL5020144

CC(C)(NS(=O)(=O)c1ccc(-c2ccc(NC(=O)c3ccc(Cl)c(Cl)c3)cc2)cc1)C1CN=NN1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.44
PCTP Q9UKL6 1/20 0.43
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MEN1 O00255 5/20 0.41
KMT2A Q03164 5/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
PKM P14618 1/20 0.41
RAB9A P51151 1/20 0.41
BCAT2 O15382 1/20 0.41
ALDH1A1 P00352 2/20 0.41
FLT1 P17948 1/20 0.40
FLT4 P35916 1/20 0.40
KDR P35968 1/20 0.40
KCNQ3 O43525 1/20 0.39
KCNQ2 O43526 1/20 0.39
KCNE1 P15382 1/20 0.39
KCNQ1 P51787 1/20 0.39

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
SCHEMBL5020190 0.88 USP30 (0.48) MEN1KMT2AMAPTALDH1A1KCNQ3
SCHEMBL3093412 0.77 PRMT1 (0.52) PRMT1PCTPCA1CA2MEN1
SCHEMBL3079053 0.75 PRMT1 (0.46) PRMT1PCTPCA1CA2MEN1
SCHEMBL5020143 0.69 MMP8 (0.39)
SCHEMBL12190100 0.66 MEN1 (0.71) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL3096015 0.65 ADAMTS4 (0.58) PRMT1CA1CA2MEN1KMT2A
SCHEMBL30926464 0.65 GRM4 (0.68) PRMT1PCTPMEN1KMT2AMAPT
SCHEMBL27181171 0.65 GRM4 (0.68) PRMT1PCTPMEN1KMT2AMAPT
SCHEMBL4254970 0.63 RAB9A (0.75) MEN1KMT2AMAPTKDM4ENPC1
SCHEMBL9467786 0.63 FLT1 (0.67) PRMT1PCTPCA1CA2MEN1

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-2012064943-A2 METALLOENZYME INHIBITOR COMPOUNDS VIAMET PHARMACEUTICALS, INC. (US) 2012-05-18 WO disclosed