SCHEMBL20144305

SCHEMBL20144305

CC(=O)Nc1ccc(CSC(=S)SCc2ccc(NC(C)=O)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 4/20 0.56
HDAC4 P56524 4/20 0.56
HDAC1 Q13547 4/20 0.56
HDAC7 Q8WUI4 4/20 0.56
HDAC2 Q92769 4/20 0.56
HDAC10 Q969S8 4/20 0.56
HDAC11 Q96DB2 4/20 0.56
HDAC8 Q9BY41 4/20 0.56
HDAC6 Q9UBN7 4/20 0.56
HDAC9 Q9UKV0 4/20 0.56
HDAC5 Q9UQL6 4/20 0.56
SMN1; SMN2 Q16637 3/20 0.50
TSHR P16473 2/20 0.50
GAA P10253 2/20 0.50
HTT P42858 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
MAPT P10636 2/20 0.49

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
SCHEMBL13461832 0.80 SMN1; SMN2 (0.59) SMN1; SMN2TSHRGAAHTTL3MBTL1
SCHEMBL2643822 0.76 SMN1; SMN2 (0.59) SMN1; SMN2TSHRHTTL3MBTL1ALDH1A1
SCHEMBL29622963 0.75 AOC3 (0.67) SMN1; SMN2TSHRHTTL3MBTL1ALDH1A1
SCHEMBL29622962 0.75 AOC3 (0.67) SMN1; SMN2TSHRHTTL3MBTL1ALDH1A1
SCHEMBL274924 0.75 TSHR (0.79) SMN1; SMN2TSHRHTTL3MBTL1ALDH1A1
SCHEMBL16092931 0.75 SMN1; SMN2 (0.53) SMN1; SMN2TSHRGAAHTTL3MBTL1
SCHEMBL14389511 0.75 TSHR (0.49) SMN1; SMN2TSHRGAAHTTL3MBTL1
SCHEMBL13598484 0.74 SMN1; SMN2 (0.57) SMN1; SMN2TSHRGAAHTTL3MBTL1
SCHEMBL861674 0.74 SMN1; SMN2 (0.84) SMN1; SMN2TSHRGAAHTTL3MBTL1
SCHEMBL25598493 0.74 PTPN1 (0.66) SMN1; SMN2TSHRGAAHTTL3MBTL1

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
US-11091659-B2 Solder mask inkjet inks for manufacturing printed circuit boards AGFA-GEVAERT (BE) 2021-08-17 US disclosed
US-20190292387-A1 SOLDER MASK INKJET INKS FOR MANUFACTURING PRINTED CIRCUIT BOARDS ELECTRA POLYMER LTD. (GB) 2019-09-26 US disclosed
EP-3321332-B1 METHOD FOR MANUFACTURING AN ELECTRONIC DEVICE, SUCH AS PRINTED CIRCUIT BOARD AGFA GEVAERT (BE) 2019-07-31 EP disclosed
WO-2018087052-A1 SOLDER MASK INKJET INKS FOR MANUFACTURING PRINTED CIRCUIT BOARDS AGFA-GEVAERT N.V. (BE) 2018-05-17 WO disclosed
EP-3321332-A1 SOLDER MASK INKJET INKS FOR MANUFACTURING PRINTED CIRCUIT BOARDS AGFA-GEVAERT (BE) 2018-05-16 EP disclosed