SCHEMBL22062002

SCHEMBL22062002

CN(C)C(=O)c1cccc(/N=N/Nc2cccc(C(=O)N(C)C)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 9/20 0.46
RAB9A P51151 9/20 0.46
MAPT P10636 7/20 0.46
SMN1; SMN2 Q16637 6/20 0.46
MEN1 O00255 6/20 0.46
KMT2A Q03164 6/20 0.46
ALDH1A1 P00352 5/20 0.46
HPGD P15428 3/20 0.46
CYP1A1 P04798 2/20 0.45
CYP1B1 Q16678 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.42
GAA P10253 3/20 0.41
NEK2 P51955 1/20 0.40
POLB P06746 1/20 0.40
KLF5 Q13887 1/20 0.40
TMPRSS2 O15393 1/20 0.38
FURIN P09958 1/20 0.38
AOC1 P19801 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
SCHEMBL22062138 0.84 CYP1A1 (0.55) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL22062006 0.82 RAB9A (0.59) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL22062003 0.81 HDAC8 (0.49) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL22062164 0.81 HPGD (0.49) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL11880967 0.81 MEN1 (0.48) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL22062142 0.81 MEN1 (0.48) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL22062166 0.80 NPC1 (0.46) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL22062005 0.78 KMT2A (0.55) NPC1RAB9AMAPTSMN1; SMN2MEN1
SCHEMBL14257246 0.75 ERN1 (0.44) SMN1; SMN2MEN1KMT2AALDH1A1HPGD
SCHEMBL8343055 0.75 HTT (0.45) MEN1KMT2AALDH1A1NEK2ERN1

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-10678156-B2 Pigment dispersion, method for manufacturing toner, aqueous ink, and triazo compound CANON KABUSHIKI KAISHA (JP) 2020-06-09 US disclosed