SCHEMBL4437686

SCHEMBL4437686

CN(C)C(=O)CCSC(=S)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HSP90AA1 P07900 2/20 0.41
HSP90AB1 P08238 1/20 0.41
HDAC3 O15379 1/20 0.40
HDAC4 P56524 1/20 0.40
HDAC1 Q13547 1/20 0.40
HDAC7 Q8WUI4 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC10 Q969S8 1/20 0.40
HDAC11 Q96DB2 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
HDAC9 Q9UKV0 1/20 0.40
HDAC5 Q9UQL6 1/20 0.40
HSD17B10 Q99714 1/20 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
SCHEMBL305519 0.83 KMT2A (0.51) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL18496979 0.81 CYP1A2 (0.48) ALDH1A1MAPTNPC1RAB9ASMN1; SMN2
SCHEMBL23690530 0.78 KMT2A (0.43) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL21578148 0.78 FAAH (0.53) ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2
SCHEMBL4073278 0.78 POLB (0.47) ALDH1A1MAPTKMT2ANPC1SMN1; SMN2
SCHEMBL16972073 0.78 ALDH1A1 (0.46) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL20425676 0.77 AKT1 (0.48) ALDH1A1MAPTKMT2ASMN1; SMN2HDAC3
SCHEMBL23690704 0.77 PHGDH (0.46) ALDH1A1MAPTSMN1; SMN2HDAC3HDAC4
SCHEMBL23732156 0.75 ALDH1A1 (0.49) ALDH1A1MAPTKMT2ANPC1RAB9A
SCHEMBL15669215 0.75 ALDH1A1 (0.53) ALDH1A1MAPTSMN1; SMN2HDAC3HDAC4

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2051861-A1 POROUS MEMBRANE AND RECORDING MEDIA COMPRISING SAME FUJIFILM Manufacturing Europe B.V. (NL) 2009-04-29 EP disclosed
EP-2051860-A1 POROUS MEMBRANES AND RECORDING MEDIA COMPRISING SAME Fuji Film Manufacturing Europe B.V. (NL) 2009-04-29 EP disclosed
WO-2008016303-A1 POROUS MEMBRANE AND RECORDING MEDIA COMPRISING SAME FUJIFILM MANUFACTURING EUROPE B.V. (NL) 2008-02-07 WO disclosed
WO-2008016301-A1 POROUS MEMBRANES AND RECORDING MEDIA COMPRISING SAME FUJIFILM MANUFACTURING EUROPE B.V. (NL) 2008-02-07 WO disclosed
WO-2003066685-A2 CHAIN TRANSFER AGENTS FOR RAFT POLYMERIZATION IN AQUEOUS MEDIA UNIVERSITY OF SOUTHERN MISSISSIPPI (US) 2003-08-14 WO disclosed