SCHEMBL13683554

SCHEMBL13683554

CN(C)C1=NN(C)C(=O)/C1=C/C=C1/Sc2ccccc2N1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.41
▸ ALDH1A1 P00352 11/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NPC1 O15118 10/20 0.40
▸ RAB9A P51151 10/20 0.40
▸ MEN1 O00255 8/20 0.40
▸ KMT2A Q03164 8/20 0.40
▸ MAPK1 P28482 5/20 0.40
▸ THRB P10828 2/20 0.40
▸ HSD17B10 Q99714 2/20 0.39
▸ SMN1; SMN2 Q16637 7/20 0.39
▸ POLB P06746 3/20 0.39
▸ LMNA P02545 1/20 0.39
▸ L3MBTL1 Q9Y468 4/20 0.39
▸ NFKB1 P19838 3/20 0.39
▸ NFKB2 Q00653 3/20 0.39
▸ RELA Q04206 3/20 0.39
▸ TP53 P04637 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ PKM P14618 2/20 0.39

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
SCHEMBL14016121 0.83 ALDH1A1 (0.43) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL13683552 0.81 ALDH1A1 (0.45) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL13683558 0.78 MAPT (0.44) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL13445655 0.78 ALDH1A1 (0.50) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL13683553 0.77 ALDH1A1 (0.44) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL13683555 0.76 RECQL (0.32) L3MBTL1
SCHEMBL13805791 0.74 MAPT (0.37) MAPTALDH1A1NPC1RAB9AMEN1
SCHEMBL13805845 0.73 MAPT (0.61) MAPTALDH1A1NPC1RAB9AMEN1
SCHEMBL25849797 0.71 ALDH1A1 (0.46) MAPTALDH1A1HPGDNPC1RAB9A
SCHEMBL10621154 0.70 ALDH1A1 (0.57) MAPTALDH1A1HPGDNPC1RAB9A

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 4 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-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
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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