SCHEMBL4977116

SCHEMBL4977116

CN1C(C)(C)CC(NC(=O)c2ccccc2)CC1(C)C

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EZH2 Q15910 4/20 0.59
KDM4E B2RXH2 2/20 0.56
GAA P10253 2/20 0.56
HDAC4 P56524 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
CARM1 Q86X55 1/20 0.51
PRMT6 Q96LA8 1/20 0.51
KMT2A Q03164 4/20 0.49
HPGD P15428 1/20 0.48
MEN1 O00255 3/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
MAOB P27338 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
CTSL P07711 1/20 0.46

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
SCHEMBL3916706 0.88 KDM4E (0.72) EZH2KDM4EGAACARM1PRMT6
SCHEMBL3916703 0.88 EZH2 (0.59) EZH2KDM4EGAAHDAC4HDAC6
SCHEMBL27628657 0.85 HDAC4 (0.55) EZH2KDM4EGAAHDAC4HDAC6
SCHEMBL20313801 0.84 EZH2 (0.56) EZH2KDM4EGAACARM1PRMT6
SCHEMBL11484910 0.84 EZH2 (0.56) EZH2KDM4EGAACARM1PRMT6
SCHEMBL9456941 0.84 HDAC4 (0.57) EZH2KDM4EGAAHDAC4HDAC6
SCHEMBL10526044 0.83 EZH2 (0.52) EZH2KDM4EGAAHDAC4HDAC6
SCHEMBL27800113 0.83 MEN1 (0.50) EZH2KDM4EGAAHDAC4HDAC6
SCHEMBL11638219 0.82 EZH2 (0.54) EZH2KDM4EGAACARM1PRMT6
SCHEMBL1414505 0.82 HDAC4 (0.53) EZH2KDM4EGAAHDAC4HDAC6

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1983987-A2 DIHYDRODIAZEPINES USEFUL AS INHIBITORS OF PROTEIN KINASES Vertex Pharmaceuticals Incorporated (US) 2008-10-29 EP disclosed
WO-2007095188-A2 DIHYDRODIAZEPINES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-08-23 WO disclosed
US-4223147-A POLYMER STABILIZERS BAYER AKTIENGESELLSCHAFT (DE) 1980-09-16 US disclosed
US-4178279-A FIBERS AND FOILS BAYER AKTIENGESELLSCHAFT (DE) 1979-12-11 US disclosed
US-4153596-A PHOTOSTABILITY BAYER AKTIENGESELLSCHAFT (DE) 1979-05-08 US disclosed
US-4145512-A Permanently stabilized polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1979-03-20 US disclosed