SCHEMBL7076299

SCHEMBL7076299

COc1ccccc1N/N=C(/N=N/c1ccccc1)c1ccccc1.Oc1ccccc1N/N=C(/N=N/c1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.45
NPC1 O15118 4/20 0.45
L3MBTL1 Q9Y468 4/20 0.45
ALDH1A1 P00352 3/20 0.41
HTT P42858 3/20 0.41
HPGD P15428 1/20 0.41
MAPT P10636 6/20 0.40
MAPK1 P28482 1/20 0.40
TP53 P04637 2/20 0.39
MDM2 Q00987 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
PTBP1 P26599 1/20 0.38
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
TSHR P16473 1/20 0.37
GAA P10253 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL3081910 0.94 RAB9A (0.50) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3081909 0.94 RAB9A (0.50) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3064889 0.88 RAB9A (0.55) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3064886 0.88 RAB9A (0.55) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3068582 0.82 GRIN2D (0.45) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL15189345 0.81 KMT2A (0.46) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3067269 0.76 RAB9A (0.59) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3067276 0.76 RAB9A (0.59) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3067229 0.74 L3MBTL1 (0.51) RAB9ANPC1L3MBTL1ALDH1A1HTT
SCHEMBL3077671 0.73 RAB9A (0.53) RAB9ANPC1L3MBTL1ALDH1A1HTT

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
WO-2003060191-A2 NON-TOXIC CORROSION-PROTECTION CONVERSION COATINGES ABSED ON COBALT UNIVERSITY OF DAYTON (US) 2003-07-24 WO disclosed