SCHEMBL9006320

SCHEMBL9006320

O=[N+]([O-])c1ccccc1/N=N/Nc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.58
MEN1 O00255 7/20 0.58
KMT2A Q03164 7/20 0.58
ALDH1A1 P00352 5/20 0.58
MAPT P10636 4/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
MAPK1 P28482 2/20 0.58
CASP3 P42574 2/20 0.58
SENP8 Q96LD8 2/20 0.58
SENP7 Q9BQF6 2/20 0.58
SENP6 Q9GZR1 2/20 0.58
NPC1 O15118 7/20 0.50
TDP1 Q9NUW8 3/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
CASP7 P55210 1/20 0.49
PLAU P00749 1/20 0.47
CYP1A1 P04798 1/20 0.47
TSHR P16473 1/20 0.47
CYP1B1 Q16678 1/20 0.47
CES2 O00748 2/20 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
SCHEMBL2003140 1.00 RAB9A (0.58) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL7999930 0.97 RAB9A (0.55) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL6129308 0.97 RAB9A (0.55) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL11291307 0.83 NPC1 (0.53) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL11291304 0.83 NPC1 (0.53) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL8045359 0.76 ALDH1A1 (0.53) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL1263552 0.75 PLAU (0.53) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL1263553 0.75 PLAU (0.53) RAB9AMEN1KMT2AALDH1A1MAPT
SCHEMBL9801440 0.74 PLAU (0.56) RAB9AMEN1KMT2AALDH1A1MAPT
Charcoal, Activated SCHEMBL5133893 0.74 PLAU (0.51) RAB9AMEN1KMT2AALDH1A1MAPT

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
US-5532320-A Second order nonlinear optical interpenetrating polymer networks UNIVERSITY OF MASSACHUSETTS LOWELL (US) 1996-07-02 US claimed