SCHEMBL5665645

SCHEMBL5665645

CCN(CC)c1ccc(C(c2ccc(SC)cc2)c2ccc(N(CC)CC)cc2C)c(C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ S100B P04271 1/20 0.44
▸ GRK6 P43250 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ MCL1 Q07820 1/20 0.39
▸ SLC6A4 P31645 1/20 0.38
▸ KMT2A Q03164 3/20 0.35
▸ ATM Q13315 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ TERT O14746 1/20 0.35
▸ ALDH1A1 P00352 6/20 0.35
▸ L3MBTL1 Q9Y468 4/20 0.35
▸ HPGD P15428 3/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ HSP90AA1 P07900 1/20 0.35

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
SCHEMBL10952039 0.89 S100B (0.53) S100BGRK6MAPTHTTGAA
SCHEMBL5665654 0.89 S100B (0.41) S100BGRK6MAPTSLC6A4KMT2A
SCHEMBL658351 0.88 S100B (0.51) S100BGRK6MAPTHTTGAA
SCHEMBL29371256 0.85 S100B (0.49) S100BGRK6MAPTHTTGAA
SCHEMBL215745 0.85 S100B (0.49) S100BGRK6MAPTHTTGAA
SCHEMBL13804083 0.85 S100B (0.51) S100BGRK6MAPTHTTGAA
SCHEMBL656825 0.85 S100B (0.51) S100BGRK6MAPTHTTGAA
SCHEMBL6248420 0.84 S100B (0.47) S100BGRK6MAPTHTTGAA
SCHEMBL11105809 0.84 S100B (0.47) S100BGRK6MAPTHTTGAA
SCHEMBL5555826 0.84 S100B (0.47) S100BGRK6MAPTHTTGAA

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-20060078802-A1 Holographic storage medium SABIC INNOVATIVE PLASTICS IP B.V. 2006-04-13 — — US disclosed
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