Nitrogen

Nitrogen

SCHEMBL10784339

CCCCOc1ccc(OCCCC)c(-c2ccc(OC)cc2)c1.N#N

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 5/20 0.49
LMNA P02545 2/20 0.44
HTT P42858 2/20 0.44
CNR2 P34972 1/20 0.44
TSHR P16473 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 4/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
HPGD P15428 3/20 0.43
AHR P35869 1/20 0.43
ATM Q13315 1/20 0.43
PTGDR2 Q9Y5Y4 1/20 0.43
BACE1 P56817 1/20 0.42
ALDH1A1 P00352 3/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
GAA P10253 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL8010942 0.86 PTPN11 (0.53) CNR2TSHRCYP3A4CYP2D6PTPN11
SCHEMBL17490620 0.81 CYP2D6 (0.54) CNR2SMN1; SMN2CYP3A4CYP2D6NPC1
SCHEMBL10784333 0.78 BACE1 (0.42) SYKLMNAHTTCNR2TSHR
SCHEMBL28158844 0.77 SYK (0.59) SYKSMN1; SMN2MAPTL3MBTL1HPGD
SCHEMBL11086322 0.76 PPARA (0.60) SYKTSHRSMN1; SMN2PTGDR2BACE1
Nitrogen SCHEMBL11326058 0.76 NQO1 (0.50) SYKTSHRSMN1; SMN2MAPTL3MBTL1
SCHEMBL14354863 0.76 CYP2D6 (0.51) SMN1; SMN2MAPTL3MBTL1ALDH1A1CYP3A4
SCHEMBL19612285 0.75 MAPT (0.53) LMNAHTTTSHRSMN1; SMN2MAPT
SCHEMBL8940719 0.74 NR5A1 (0.49) CNR2MAPTL3MBTL1ALDH1A1MEN1
SCHEMBL22561127 0.74 CNR2 (0.43) SYKLMNAHTTCNR2MAPT

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
EP-0080241-B1 DIAZOTYPE MATERIAL Océ-Nederland B.V. (NL) 1987-09-09 EP disclosed