SCHEMBL5330770

SCHEMBL5330770

[CH2]Cc1ccccc1S(=O)(=O)CC=C

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PLCG1 P19174 1/20 0.33
PNMT P11086 1/20 0.32
CTSB P07858 1/20 0.31
POLB P06746 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
TSHR P16473 1/20 0.30

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
SCHEMBL5412466 0.85 ALDH1A1 (0.47) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL27921135 0.84 ALDH1A1 (0.46) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL28057995 0.81 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL10180094 0.81 ALDH1A1 (0.44) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL10180394 0.80 ALDH1A1 (0.43) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL10179424 0.78 ALDH1A1 (0.42) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL1204858 0.77 ALDH1A1 (0.54) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL707747 0.76 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL4277651 0.76 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL11079398 0.76 ALDH1A1 (0.49) ALDH1A1KDM4EMEN1KMT2ALMNA

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
EP-1863771-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS Transtech Pharma, Inc. (US) 2007-12-12 EP claimed
WO-2006099379-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS TRANSTECH PHARMA, INC. (US) 2006-09-21 WO claimed
EP-1863771-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS Transtech Pharma, Inc. (US) 2007-12-12 EP disclosed
WO-2006099379-A2 BENZAZOLE DERIVATIVES, COMPOSITIONS, AND METHODS OF USE AS B-SECRETASE INHIBITORS TRANSTECH PHARMA, INC. (US) 2006-09-21 WO disclosed