SCHEMBL9874375

SCHEMBL9874375

O=c1c2cc([N+](=O)[O-])ccc2cnn1CCCl

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GLS O94925 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
MIF P14174 1/20 0.42
G6PD P11413 1/20 0.41
TLR9 Q9NR96 1/20 0.41
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.40
NPC1 O15118 1/20 0.39
MITF O75030 1/20 0.39
PKM P14618 1/20 0.39
RAB9A P51151 1/20 0.39
LMNA P02545 1/20 0.38
CYP3A4 P08684 1/20 0.38
ALOX15 P16050 1/20 0.38
NOS1 P29475 1/20 0.38
KAT2B Q92831 1/20 0.38

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
SCHEMBL14966061 0.84 CNR1 (0.52) GLSL3MBTL1MEN1KMT2AMAPT
SCHEMBL5863497 0.83 TDP1 (0.51) MEN1KMT2AG6PDTLR9KAT2B
SCHEMBL14966684 0.82 GLS (0.45) GLSL3MBTL1MEN1KMT2AMIF
SCHEMBL14966246 0.81 GLS (0.44) GLSL3MBTL1MEN1KMT2AMIF
SCHEMBL14965963 0.80 L3MBTL1 (0.50) GLSL3MBTL1MEN1KMT2AG6PD
SCHEMBL28899217 0.78 MAPT (0.52) MEN1KMT2AMAPTKAT2B
SCHEMBL14965797 0.78 CNR2 (0.42) GLSMEN1KMT2AG6PDTLR9
SCHEMBL5864200 0.77 CFTR (0.48) GLSL3MBTL1G6PDTLR9POLB
SCHEMBL5864274 0.77 PDE5A (0.43) GLSL3MBTL1MEN1KMT2APOLB
SCHEMBL14966025 0.74 MEN1 (0.44) GLSL3MBTL1MEN1KMT2AG6PD

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-4983606-A Pharmaceutically-active phthalazine compounds ZAMBON GROUP S.P.A. (IT) 1991-01-08 US disclosed