SCHEMBL8958425

SCHEMBL8958425

CCCCCCCCNN=Nc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.50
MAPT P10636 7/20 0.48
ALDH1A1 P00352 6/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
RAB9A P51151 2/20 0.48
MAPK1 P28482 1/20 0.48
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
NPC1 O15118 1/20 0.46
GAA P10253 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
CHRM2 P08172 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL8958421 1.00 MGLL (0.50) MGLLMAPTALDH1A1MEN1KMT2A
SCHEMBL3342373 0.82 MAPT (0.54) MGLLMAPTALDH1A1MEN1KMT2A
SCHEMBL10877789 0.82 MAPT (0.54) MGLLMAPTALDH1A1MEN1KMT2A
SCHEMBL10877793 0.82 MAPT (0.54) MGLLMAPTALDH1A1MEN1KMT2A
SCHEMBL3342369 0.82 MAPT (0.54) MGLLMAPTALDH1A1MEN1KMT2A
SCHEMBL3427340 0.79 MAPT (0.55) MAPTALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL10428051 0.77 NAAA (0.44) ALDH1A1HTT
SCHEMBL8958323 0.77 NAAA (0.44) ALDH1A1HTT
SCHEMBL10428049 0.77 NAAA (0.44) ALDH1A1HTT
SCHEMBL15485856 0.77 KCNH2 (0.66) MAPTALDH1A1CHRM2LMNAKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5523436-A ARYL-ALKYL TRIAZENIDO TRANSITION METAL COMPLEXES; HIGH ACTIVATION ENERGY; CROSSLINKED POLYSILOXANES WACKER-CHEMIE GMBH (DE) 1996-06-04 US disclosed
EP-0602638-B1 Catalysts for hydrosilylation reactions WACKER CHEMIE GMBH (DE) 1996-03-06 EP disclosed
EP-0636642-B1 Transition metal complexes bound to organopolysiloxanes WACKER CHEMIE GMBH (DE) 1995-12-06 EP disclosed
EP-0636642-A1 Transition metal complexes bound to organopolysiloxanes Wacker-Chemie GmbH (DE) 1995-02-01 EP disclosed
EP-0602638-A1 Catalysts for hydrosilylation reactions Wacker-Chemie GmbH (DE) 1994-06-22 EP disclosed