SCHEMBL19214675

SCHEMBL19214675

Ic1nc2c(ccc3scnc32)s1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32
HSD17B10 Q99714 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
MELK Q14680 1/20 0.30

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
SCHEMBL19214702 0.83 GAA (0.35) ALDH1A1
SCHEMBL5160632 0.78 ALDH1A1 (0.46) ALDH1A1HSD17B10EGLN1MELK
SCHEMBL18909186 0.77 ALDH1A1 (0.46) ALDH1A1HSD17B10
SCHEMBL16438237 0.77 NPC1 (0.45) ALDH1A1HSD17B10EGLN1
SCHEMBL18309107 0.73 ACACB (0.37) EGLN1
SCHEMBL19730978 0.73 NPC1 (0.43) ALDH1A1EGLN1
SCHEMBL10054252 0.69 ALDH1A1 (0.38) ALDH1A1HSD17B10EGLN1MELK
SCHEMBL18499848 0.67 RAB9A (0.39) ALDH1A1HSD17B10
SCHEMBL22025575 0.67 ALDH1A1 (0.33) ALDH1A1HSD17B10EGLN1
SCHEMBL22026196 0.67 PI4KA (0.34) ALDH1A1HSD17B10

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-10388881-B2 Sorting of carbon nanotubes BASF SE (DE) 2019-08-20 US disclosed
US-20170229657-A1 SORTING OF CARBON NANOTUBES CLAP CO., LTD. (KR) 2017-08-10 US disclosed