SCHEMBL4306305

SCHEMBL4306305

O=C(NC1CCCN(S(=O)(=O)c2cccs2)C1)C1CCCCC1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.78
MEN1 O00255 4/20 0.66
KMT2A Q03164 4/20 0.66
KDM4E B2RXH2 1/20 0.62
RAB9A P51151 1/20 0.61
SMN1; SMN2 Q16637 2/20 0.61
POLB P06746 1/20 0.61
ALDH1A1 P00352 2/20 0.60
GAA P10253 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
MAPK1 P28482 2/20 0.58
HTT P42858 1/20 0.56
HCRTR1 O43613 1/20 0.56
MAPT P10636 1/20 0.56

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
SCHEMBL4146591 1.00 EPHX2 (0.78) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL5245759 0.94 EPHX2 (0.79) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL5244399 0.93 EPHX2 (0.77) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL5242567 0.93 EPHX2 (0.77) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL5246442 0.93 EPHX2 (0.77) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL612941 0.86 EPHX2 (0.76) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL612942 0.86 EPHX2 (0.76) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL4005679 0.81 EPHX2 (0.76) EPHX2MEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL5246527 0.81 KDM4E (0.72) EPHX2MEN1KMT2AKDM4ERAB9A
SCHEMBL5282637 0.80 MEN1 (0.72) EPHX2MEN1KMT2AKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778229-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2009-06-17 EP disclosed
EP-1778229-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-05-02 EP disclosed
WO-2006020598-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-23 WO disclosed