SCHEMBL397777

SCHEMBL397777

C/C(=C\c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 4/20 0.55
LMNA P02545 4/20 0.45
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.44
PTGS2 P35354 2/20 0.42
AKR1C2 P52895 2/20 0.42
AKR1C1 Q04828 2/20 0.42
KDM4E B2RXH2 1/20 0.41
KMT2A Q03164 1/20 0.41
GAA P10253 1/20 0.40
P4HB P07237 1/20 0.40

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
SCHEMBL397778 1.00 AKR1C3 (0.55) AKR1C3LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL394848 0.83 LMNA (0.53) AKR1C3LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL394847 0.83 LMNA (0.53) AKR1C3LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL396068 0.81 AKR1C3 (0.53) AKR1C3LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL396069 0.81 AKR1C3 (0.53) AKR1C3LMNAALDH1A1SMN1; SMN2HTT
SCHEMBL4803009 0.81 AKR1C3 (0.65) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL27792566 0.81 AKR1C3 (0.60) AKR1C3LMNASMN1; SMN2PTGS2AKR1C2
SCHEMBL8490337 0.81 AKR1C3 (0.65) AKR1C3PTGS2AKR1C2AKR1C1
SCHEMBL2462984 0.80 AKR1C3 (0.82) AKR1C3ALDH1A1HTTKDM4E
SCHEMBL2462983 0.80 AKR1C3 (0.82) AKR1C3ALDH1A1HTTKDM4E

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 2 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