SCHEMBL8782856

SCHEMBL8782856

NC(=O)N(O)CCNC(=O)c1cccn1Cc1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
CNR2 P34972 8/20 0.48
KDM4E B2RXH2 3/20 0.46
SCN3A Q9NY46 3/20 0.45
CNR1 P21554 3/20 0.41
VEGFA P15692 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
ALDH1A1 P00352 2/20 0.40
RECQL P46063 1/20 0.40
SCN5A Q14524 1/20 0.40
SCN9A Q15858 1/20 0.40
LMNA P02545 1/20 0.40
MAP3K14 Q99558 1/20 0.40
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 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
SCHEMBL8942600 0.84 KDM4E (0.46) NPC1RAB9ACNR2KDM4ESCN3A
SCHEMBL8782677 0.76 CYP1A2 (0.61) NPC1RAB9AKDM4EALDH1A1LMNA
SCHEMBL8942396 0.71 VEGFA (0.57) NPC1RAB9ACNR2KDM4ESCN3A
SCHEMBL31590800 0.70 VEGFA (0.55) NPC1RAB9ACNR2KDM4ESCN3A
SCHEMBL6992210 0.70 CNR2 (0.64) NPC1RAB9ACNR2KDM4ESCN3A
SCHEMBL12803579 0.69 VEGFA (0.51) NPC1RAB9ACNR2KDM4ESCN3A
SCHEMBL8783029 0.69 ALDH1A1 (0.50) RAB9AKDM4EALDH1A1LMNAMAPT
SCHEMBL9373411 0.68 AOC3 (0.56) CNR2KDM4ECNR1ALDH1A1MEN1
SCHEMBL7186933 0.67 FEN1 (0.51) NPC1RAB9ACNR2KDM4ESCN3A
SCHEMBL8782586 0.67 SNCA (0.49) NPC1RAB9AALDH1A1LMNAMEN1

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-0595995-B1 ARYLAMIDOALKYL- AND ARYLAMINOALKYL-N-HYDROXYUREA COMPOUNDS AND -N-HYDROXYFORMAMIDE DERIVATIVES HAVING LIPOXYGENASE INHIBITORY ACTIVITY ABBOTT LAB (US) 1997-01-15 EP disclosed
US-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed
US-5214204-A Inhibitors of biosynthesis of leukotrienes ABBOTT LABORATORIES (US) 1993-05-25 US disclosed