SCHEMBL8573683

SCHEMBL8573683

O=c1[nH]sc2cccc(-c3ccccc3)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIMK1 P53667 2/20 0.50
▸ PLK4 O00444 1/20 0.50
▸ MAPK9 P45984 1/20 0.50
▸ CLK4 Q9HAZ1 1/20 0.50
▸ AKT3 Q9Y243 1/20 0.50
▸ MAPT P10636 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ HTT P42858 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ DDAH1 O94760 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ CACNA1B Q00975 1/20 0.48
▸ APBA1 Q02410 1/20 0.48
▸ PARP1 P09874 1/20 0.38
▸ PARP10 Q53GL7 1/20 0.37
▸ PARP11 Q9NR21 1/20 0.37
▸ HDAC4 P56524 1/20 0.36
▸ HDAC2 Q92769 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.36

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
SCHEMBL11437048 0.85 MAPT (0.41) LIMK1PLK4MAPK9CLK4AKT3
SCHEMBL8596062 0.72 ALDH1A1 (0.48) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL2970289 0.72 MAPT (0.48) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL11213296 0.72 ALDH1A1 (0.48) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL1710671 0.72 ALDH1A1 (0.48) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL725796 0.72 ALDH1A1 (0.48) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL10980881 0.71 PARP1 (0.49) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL6554420 0.70 HTT (0.43) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL9557407 0.70 ALDH1A1 (0.43) MAPTALDH1A1LMNAHTTKDM4E
SCHEMBL10587136 0.69 MAPT (0.46) MAPTALDH1A1LMNAHTTKDM4E

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
JP-10237329-A — — None — — JP disclosed
JP-8188506-A — — None — — JP disclosed
JP-H10237329-A ANTIMICROBIAL RESIN COMPOSITION SUMITOMO CHEM CO LTD 1998-09-08 — — JP disclosed
JP-H08188506-A MICROBICIDAL COMPOSITION SUMITOMO CHEM CO LTD 1996-07-23 — — JP disclosed
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