SCHEMBL398264

SCHEMBL398264

CC(=Cc1ccc(S(=O)(=O)NC(C)(C)C)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 2/20 0.50
AKR1C2 P52895 1/20 0.47
AKR1C1 Q04828 1/20 0.47
ALDH1A1 P00352 6/20 0.46
MAPT P10636 3/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HDAC1 Q13547 1/20 0.46
CYP3A4 P08684 3/20 0.43
CYP2C9 P11712 3/20 0.43
MAPK1 P28482 2/20 0.43
LMNA P02545 4/20 0.43
HPGD P15428 2/20 0.42
CYP2D6 P10635 2/20 0.41
CYP2C19 P33261 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
PKM P14618 1/20 0.41
CNR1 P21554 1/20 0.41
HTT P42858 1/20 0.41
GPR55 Q9Y2T6 1/20 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
SCHEMBL398263 1.00 AKR1C3 (0.50) AKR1C3AKR1C2AKR1C1ALDH1A1MAPT
SCHEMBL398533 0.83 MAPT (0.54) AKR1C3AKR1C2ALDH1A1MAPTSMN1; SMN2
SCHEMBL398534 0.83 MAPT (0.54) AKR1C3AKR1C2ALDH1A1MAPTSMN1; SMN2
SCHEMBL395694 0.83 AKR1C3 (0.55) AKR1C3AKR1C2AKR1C1ALDH1A1SMN1; SMN2
SCHEMBL395693 0.83 AKR1C3 (0.55) AKR1C3AKR1C2AKR1C1ALDH1A1SMN1; SMN2
SCHEMBL396596 0.79 ALDH1A1 (0.52) AKR1C3AKR1C2AKR1C1ALDH1A1SMN1; SMN2
SCHEMBL396595 0.79 ALDH1A1 (0.52) AKR1C3AKR1C2AKR1C1ALDH1A1SMN1; SMN2
SCHEMBL396739 0.78 HDAC1 (0.69) AKR1C3AKR1C2AKR1C1ALDH1A1HDAC1
SCHEMBL396738 0.78 HDAC1 (0.69) AKR1C3AKR1C2AKR1C1ALDH1A1HDAC1
SCHEMBL397043 0.77 ALDH1A1 (0.48) AKR1C3ALDH1A1MAPTSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8101332-B2 Negative-working lithographic printing plate precursor and method of lithographic printing using same FUJIFILM CORPORATION (JP) 2012-01-24 US disclosed
US-20090246688-A1 NEGATIVE-WORKING LITHOGRAPHIC PRINTING PLATE PRECURSOR AND METHOD OF LITHOGRAPHIC PRINTING USING SAME FUJIFILM CORPORATION (JP) 2009-10-01 US disclosed
EP-2105298-A1 Negative-working lithographic printing plate precursor and method of lithographic printing using same Fujifilm Corporation (JP) 2009-09-30 EP disclosed