SCHEMBL5282584

SCHEMBL5282584

Cc1nc(Cl)cnc1Cl.Cc1nc(N2CCC(C(=O)O)CC2)cnc1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.50
HTT P42858 1/20 0.50
KDM4E B2RXH2 2/20 0.46
USP2 O75604 1/20 0.46
HPGD P15428 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP2C19 P33261 1/20 0.43
NEK2 P51955 5/20 0.39
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NOTUM Q6P988 4/20 0.38
PLK1 P53350 1/20 0.38
NEK1 Q96PY6 1/20 0.38
SCN9A Q15858 1/20 0.38

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
SCHEMBL4890730 0.95 LMNA (0.51) LMNAHTTKDM4EUSP2HPGD
SCHEMBL30890339 0.77 LMNA (0.58) LMNAHTTKDM4EUSP2HPGD
SCHEMBL31381338 0.75 LMNA (0.59) LMNAHTTKDM4EUSP2HPGD
SCHEMBL22875307 0.72 KDM4E (0.57) LMNAHTTKDM4EUSP2HPGD
SCHEMBL25295618 0.70 MAPT (0.67) LMNAHTTKDM4EHPGDNPSR1
SCHEMBL31303093 0.70 MAPT (0.67) LMNAHTTKDM4EHPGDNPSR1
SCHEMBL4883086 0.69
SCHEMBL239335 0.69 LMNA (0.55) LMNAHTTKDM4EUSP2HPGD
SCHEMBL31381165 0.69 LMNA (0.62) LMNAHTTKDM4ECYP2C19NOTUM
SCHEMBL25197786 0.69 LMNA (0.58) LMNAHTTKDM4EUSP2HPGD

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-2007008146-A1 HETEROCYCLIC SULFONAMIDE DERIVATIVES AS INHIBITORS OF FACTOR XA ASTRAZENECA AB (SE) 2007-01-18 WO disclosed