SCHEMBL7987027

SCHEMBL7987027

CN(C)c1ccc(/N=N/c2ccc(/N=N/c3ccc([N+](=O)[O-])cc3)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.64
MAPK1 P28482 6/20 0.64
TSHR P16473 4/20 0.64
TDP1 Q9NUW8 3/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
PHLPP2 Q6ZVD8 1/20 0.64
L3MBTL1 Q9Y468 1/20 0.64
NPC1 O15118 7/20 0.59
MEN1 O00255 7/20 0.59
KMT2A Q03164 7/20 0.59
RAB9A P51151 6/20 0.59
TNNI3 P19429 1/20 0.59
TNNT2 P45379 1/20 0.59
TNNC1 P63316 1/20 0.59
KEAP1 Q14145 1/20 0.59
NFE2L2 Q16236 1/20 0.59
SMN1; SMN2 Q16637 1/20 0.59
MMP14 P50281 1/20 0.57
ALDH1A1 P00352 5/20 0.55

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
SCHEMBL7987030 1.00 MAPT (0.64) MAPTMAPK1TSHRTDP1CYP1A2
SCHEMBL2384564 1.00 MAPT (0.64) MAPTMAPK1TSHRTDP1CYP1A2
SCHEMBL2384567 1.00 MAPT (0.64) MAPTMAPK1TSHRTDP1CYP1A2
SCHEMBL218018 0.88 MAPT (0.78) MAPTMAPK1TSHRTDP1CYP1A2
Phosphine SCHEMBL30201038 0.86 MAPT (0.75) MAPTMAPK1TSHRTDP1CYP1A2
Ammonia Solution, Strong SCHEMBL29558993 0.86 MAPT (0.75) MAPTMAPK1TSHRTDP1CYP1A2
Hydrogen Sulfide SCHEMBL28326954 0.86 MAPT (0.75) MAPTMAPK1TSHRTDP1CYP1A2
SCHEMBL18025268 0.84 MAPT (0.49) MAPTMAPK1TSHRTDP1CYP1A2
Iodide SCHEMBL10484653 0.84 MAPT (0.72) MAPTMAPK1TSHRTDP1CYP1A2
SCHEMBL3282773 0.84 MEN1 (0.61) MAPTMAPK1TDP1NPC1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6288206-B1 MIXED WITH DYE; HEAT RESISTANCE, STABILITY; ELECTROOPTICS; MOLECULAR OPTOELECTRONICS CORPORATION 2001-09-11 US disclosed
WO-2000054103-A1 CHIRAL POLYMER COMPOSITIONS EXHIBITING NONLINEAR OPTICAL PROPERTIES MOLECULAR OPTOELECTRONICS CORPORATION (US) 2000-09-14 WO disclosed