SCHEMBL6296148

SCHEMBL6296148

O=[N+]([O-])c1ccc(NC(=S)NCCN2CCOCC2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.68
KDM4E B2RXH2 1/20 0.68
KMT2A Q03164 1/20 0.68
SMN1; SMN2 Q16637 1/20 0.68
GAA P10253 3/20 0.65
MAPT P10636 2/20 0.65
ALDH1A1 P00352 5/20 0.64
PKM P14618 1/20 0.64
NPC1 O15118 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C19 P33261 1/20 0.61
CA1 P00915 1/20 0.61
CA2 P00918 1/20 0.61
CA9 Q16790 1/20 0.61
RECQL P46063 1/20 0.59

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
SCHEMBL30417071 0.87 ALDH1A1 (0.76) LMNAKMT2ASMN1; SMN2GAAMAPT
SCHEMBL14978294 0.81 LMNA (0.76) LMNAKDM4EKMT2ASMN1; SMN2GAA
SCHEMBL2378489 0.81 PKM (0.66) LMNAKMT2ASMN1; SMN2GAAMAPT
SCHEMBL5451782 0.81 GAA (0.90) LMNAKDM4EKMT2ASMN1; SMN2GAA
SCHEMBL7040997 0.79 LMNA (0.69) LMNAKDM4EKMT2ASMN1; SMN2ALDH1A1
SCHEMBL4749977 0.79 ATM (0.68) LMNAKMT2AMAPTALDH1A1CYP2C19
SCHEMBL14574160 0.76 ALDH1A1 (0.72) LMNAKMT2ASMN1; SMN2GAAMAPT
SCHEMBL5067764 0.76 LMNA (0.59) LMNAKMT2ASMN1; SMN2MAPTALDH1A1
SCHEMBL2376571 0.76 MAPT (0.68) LMNAKDM4EKMT2ASMN1; SMN2GAA
SCHEMBL6323061 0.76 LMNA (0.78) LMNAKMT2ASMN1; SMN2MAPTALDH1A1

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
US-6875764-B1 Urea and thiourea compounds useful for treatment of coccidiosis NEW PHARMA RESEARCH SWEDEN AB (SE) 2005-04-05 US disclosed
EP-1224165-A1 NOVEL COMPOUNDS New Pharma Research Sweden AB (SE) 2002-07-24 EP disclosed
WO-2001030749-A1 NOVEL COMPOUNDS NEW PHARMA RESEARCH SWEDEN AB (SE) 2001-05-03 WO disclosed