SCHEMBL4760882

SCHEMBL4760882

CCN(CCOc1ccccc1)C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.54
LMNA P02545 2/20 0.54
ALOX15 P16050 1/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 1/20 0.54
HSD17B10 Q99714 1/20 0.54
PARP10 Q53GL7 1/20 0.50
RAB9A P51151 1/20 0.48
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
LTA4H P09960 2/20 0.46
PTPN7 P35236 1/20 0.46
DUSP3 P51452 1/20 0.46
RECQL P46063 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45

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
SCHEMBL5457872 0.84 MMP2 (0.42) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL7973829 0.84 NPC1 (0.54) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL465562 0.81 LTA4H (0.59) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL11541051 0.76 BCHE (0.46) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL10882164 0.76 GAA (0.59) LMNAMAPK1KDM4EMEN1KMT2A
Anisole SCHEMBL27882352 0.76 ALOX5 (0.53) NPC1LMNAHSD17B10RAB9AMEN1
SCHEMBL10876242 0.76 LTA4H (0.67) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL11409110 0.75 PARP10 (0.50) NPC1ALOX15PARP10RAB9AMEN1
SCHEMBL9862875 0.75 NPC1 (0.58) NPC1LMNAALOX15TSHRMAPK1
SCHEMBL10880334 0.75 NPC1 (0.48) NPC1LMNAALOX15TSHRMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689393-A4 PREPARATION OF 1,7-DISUBSTITUTED AZABENZIMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LTD (GB) 2008-12-17 EP disclosed
EP-1689393-A2 PREPARATION OF 1,7-DISUBSTITUTED AZABENZIMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2006-08-16 EP disclosed
WO-2005037198-A2 PREPARATION OF 1,7-DISUBSTITUTED AZABENZIMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-04-28 WO disclosed
WO-2001007409-A1 CARBAZOLE DERIVATIVES AND THEIR USE AS NEUROPEPTIDE Y5 RECEPTOR LIGANDS ASTRAZENECA UK LIMITED (GB) 2001-02-01 WO disclosed