SCHEMBL28601366

SCHEMBL28601366

Cc1nc2cc(N=NCS(=O)(=O)CN=Nc3ccc4sc(C)nc4c3)ccc2s1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.49
▸ SMN1; SMN2 Q16637 6/20 0.49
▸ MAPT P10636 3/20 0.49
▸ HTT P42858 3/20 0.49
▸ GAA P10253 2/20 0.49
▸ POLB P06746 2/20 0.47
▸ NPC1 O15118 3/20 0.46
▸ RAB9A P51151 3/20 0.46
▸ HSD17B10 Q99714 2/20 0.46
▸ TP53 P04637 3/20 0.42
▸ LMNA P02545 3/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ PKM P14618 4/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KMT2A Q03164 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 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
SCHEMBL28601361 0.81 SMN1; SMN2 (0.49) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL19672580 0.76 SMN1; SMN2 (0.56) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL14549411 0.72 SMN1; SMN2 (0.48) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL28601433 0.69 POLB (0.57) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL15880406 0.69 SMN1; SMN2 (0.47) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL6141396 0.68 POLB (0.68) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL28605540 0.68 MAPT (0.42) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL14612413 0.67 POLB (0.66) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL84337 0.67 POLB (0.66) ALDH1A1SMN1; SMN2MAPTHTTGAA
SCHEMBL3524765 0.67 POLB (0.66) ALDH1A1SMN1; SMN2MAPTHTTGAA

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
CN-113024430-A Process for converting substituted arylamines to arylazomethylsulfones 天津师范大学 2021-06-25 — — CN disclosed
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