SCHEMBL13683628

SCHEMBL13683628

CNC(=O)C1=NN(C)C(=O)/C1=C/C=C1N(C)c2ccccc2N1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ MTOR P42345 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ EPHX2 P34913 2/20 0.34
▸ BRD4 O60885 1/20 0.32
▸ MAPT P10636 4/20 0.31
▸ LMNA P02545 3/20 0.31
▸ L3MBTL1 Q9Y468 3/20 0.31
▸ MAPK1 P28482 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ GAA P10253 2/20 0.31
▸ HTT P42858 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ TDP1 Q9NUW8 2/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NR4A2 P43354 1/20 0.31
▸ EGFR P00533 3/20 0.31
▸ SRC P12931 1/20 0.31

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
SCHEMBL13683636 0.86 TRPA1 (0.32) TRPA1NPC1MTORRAB9AEPHX2
SCHEMBL13683624 0.86 TRPA1 (0.40) TRPA1NPC1MTORRAB9AEPHX2
SCHEMBL13683629 0.80 MAPT (0.42) NPC1RAB9AMAPTLMNAL3MBTL1
SCHEMBL13683639 0.77 TRPA1 (0.35) TRPA1NPC1MTORRAB9AEPHX2
SCHEMBL13683810 0.77 KMT2A (0.45) TRPA1NPC1MTORRAB9AEPHX2
SCHEMBL13683627 0.75 EPHX2 (0.33) TRPA1NPC1MTORRAB9AEPHX2
SCHEMBL13683644 0.74 — —
SCHEMBL13683621 0.73 L3MBTL1 (0.50) TRPA1NPC1MTORRAB9AEPHX2
SCHEMBL13683637 0.69 MAPT (0.40) MAPTLMNAL3MBTL1MAPK1MEN1
SCHEMBL13683632 0.68 MAPT (0.40) MAPTL3MBTL1MAPK1MEN1GAA

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-7595139-B2 Metal complex dye, color toner and color filter KONICA MINOLTA HOLDINGS, INC. (JP) 2009-09-29 — — US disclosed
US-7553797-B2 Thermal transfer recording material and thermal transfer recording method KONICA MINOLTA PHOTO IMAGING, INC. (JP) 2009-06-30 — — US disclosed
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