SCHEMBL22062001

SCHEMBL22062001

COC(=O)c1cccc(N/N=N/c2ccccc2)c1

nearest known ligand 0.72

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.72
NPC1 O15118 8/20 0.72
SMN1; SMN2 Q16637 5/20 0.72
MAPT P10636 5/20 0.72
ALDH1A1 P00352 4/20 0.72
HPGD P15428 3/20 0.72
MEN1 O00255 3/20 0.66
KMT2A Q03164 3/20 0.66
L3MBTL1 Q9Y468 2/20 0.56
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
TSHR P16473 2/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1B1 Q16678 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
POLB P06746 1/20 0.51
HIF1A Q16665 1/20 0.48

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
SCHEMBL22062144 0.84 RAB9A (1.00) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
Azobenzene SCHEMBL28325034 0.83 RAB9A (0.74) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL28393989 0.82 RAB9A (0.72) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL10818316 0.82 RAB9A (0.72) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL22062005 0.81 KMT2A (0.55) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL18133122 0.79 RAB9A (0.61) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL22062006 0.79 RAB9A (0.59) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
Azobenzene SCHEMBL28437893 0.78 RAB9A (0.89) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL22062138 0.78 CYP1A1 (0.55) RAB9ANPC1SMN1; SMN2MAPTALDH1A1
SCHEMBL1745412 0.77 RAB9A (0.71) RAB9ANPC1SMN1; SMN2MAPTALDH1A1

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