SCHEMBL9906806

SCHEMBL9906806

COCCOC(=O)CSSCCOC(=O)CSC(=S)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
HDAC3 O15379 6/20 0.37
HDAC4 P56524 6/20 0.37
HDAC1 Q13547 6/20 0.37
HDAC7 Q8WUI4 6/20 0.37
HDAC2 Q92769 6/20 0.37
HDAC10 Q969S8 6/20 0.37
HDAC11 Q96DB2 6/20 0.37
HDAC8 Q9BY41 6/20 0.37
HDAC6 Q9UBN7 6/20 0.37
HDAC9 Q9UKV0 6/20 0.37
HDAC5 Q9UQL6 6/20 0.37
SMN1; SMN2 Q16637 3/20 0.36
HPGD P15428 2/20 0.36
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.34
TDP1 Q9NUW8 3/20 0.33
LMNA P02545 2/20 0.33

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
SCHEMBL13050748 0.91 TSHR (0.45) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL9906821 0.82 TDP1 (0.33) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL13320409 0.79 LMNA (0.54) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL4231270 0.76 MAPT (0.49) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL3048238 0.75 TSHR (0.46) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL9906805 0.75 LMNA (0.43) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL18036991 0.73 ALDH1A1 (0.43) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL17101653 0.72 LMNA (0.43) HDAC1HDAC2SMN1; SMN2HPGDMAPT
SCHEMBL22204622 0.72 HDAC3 (0.44) TSHRHDAC3HDAC4HDAC1HDAC7
SCHEMBL13107756 0.72 TSHR (0.42) TSHRSMN1; SMN2HPGDMAPTKMT2A

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
US-8546488-B2 Cleavable block copolymers, functionalized nanoporous thin films and related methods of preparation UNIVERSITY OF MASSACHUSETTS (US) 2013-10-01 US disclosed
US-20120245244-A1 Cleavable block copolymers, functionalized nanoporous thin films and related methods of preparation NATIONAL SCIENCE FOUNDATION 2012-09-27 US disclosed
US-8198368-B2 Cleavable block copolymers, functionalized nanoporous thin films and related methods of preparation UNIVERSITY OF MASSACHUSETTS (US) 2012-06-12 US disclosed
US-20090105427-A1 Cleavable Block Copolymers, Functionalized Nanoporous Thin Films and Related Methods of Preparation UNIVERSITY OF MASSACHUSETTS 2009-04-23 US disclosed