SCHEMBL3942397

SCHEMBL3942397

C=CC(=O)OCCS(=O)(=O)c1ccc2ccccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
HTT P42858 3/20 0.51
GAA P10253 2/20 0.51
KDM4E B2RXH2 2/20 0.49
HPGD P15428 2/20 0.49
THRB P10828 1/20 0.48
CAPN1 P07384 2/20 0.42
CTSB P07858 2/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
MEN1 O00255 2/20 0.41

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
SCHEMBL9568514 0.83 ALDH1A1 (0.56) ALDH1A1GAASMN1; SMN2LMNAPOLB
SCHEMBL28734421 0.83 THRB (0.55) ALDH1A1HPGDTHRBHDAC3HDAC4
SCHEMBL9464166 0.79 KMT2A (0.45) ALDH1A1HTTGAAHPGDTHRB
SCHEMBL28625109 0.78 THRB (0.38) ALDH1A1HTTGAAHPGDTHRB
SCHEMBL11044833 0.77 ALDH1A1 (0.50) ALDH1A1GAAKMT2ACYP3A4LMNA
SCHEMBL9554718 0.77 HSP90AA1 (0.39) ALDH1A1GAAHPGDTHRBMEN1
SCHEMBL9043466 0.77 ALDH1A1 (0.51) ALDH1A1HTTGAAKDM4EHPGD
SCHEMBL28746963 0.76 F2 (0.46) ALDH1A1HTTGAAKDM4EHPGD
SCHEMBL5270056 0.75 THRB (0.54) ALDH1A1KDM4EHPGDTHRBHDAC1
SCHEMBL5267795 0.74 THRB (0.56) ALDH1A1KDM4EHPGDTHRBHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1692551-B1 COMPOSITION FOR MICROSTRUCTURED SCREENS 3M INNOVATIVE PROPERTIES CO (US) 2009-04-15 EP disclosed
US-7142361-B2 Optical material adhesive, film including optical material and projection screen including film 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-11-28 US disclosed
EP-1692551-A1 COMPOSITION FOR MICROSTRUCTURED SCREENS 3M Innovative Properties Company (US) 2006-08-23 EP disclosed
US-7050227-B2 Composition for microstructured screens 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-05-23 US disclosed
US-20050152032-A1 Composition for microstructured screens 3M INNOVATIVE PROPERTIES COMPANY 2005-07-14 US disclosed
WO-2005062081-A1 COMPOSITION FOR MICROSTRUCTURED SCREENS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-07-07 WO disclosed
US-20050128580-A1 COMPOSITION FOR MICROSTRUCTURED SCREENS 3M INNOVATIVE PROPERTIES COMPANY 2005-06-16 US disclosed