SCHEMBL5430264

SCHEMBL5430264

O=C(c1ccccc1)C(c1ccccc1)N1c2ccccc2S(=O)(=O)c2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.46
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
RXFP1 Q9HBX9 2/20 0.44
TDP1 Q9NUW8 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HDAC1 Q13547 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
MAOA P21397 1/20 0.38
TP53 P04637 2/20 0.38
THRB P10828 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
CHEK1 O14757 1/20 0.36

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
SCHEMBL5425626 0.77 BCHE (0.53) LMNACES2CES1TDP1L3MBTL1
SCHEMBL6319092 0.71 LMNA (0.52) LMNACES2CES1TDP1L3MBTL1
SCHEMBL19742355 0.68 RXFP1 (0.47) LMNARXFP1MEN1KMT2AMAOA
SCHEMBL9366693 0.65 GAA (0.70) LMNACES2CES1L3MBTL1MEN1
Benzoin SCHEMBL10665271 0.65 CES2 (1.00) LMNACES2CES1TDP1L3MBTL1
Benzoin SCHEMBL901258 0.65 CES2 (1.00) LMNACES2CES1TDP1L3MBTL1
Benzoin SCHEMBL5833429 0.65 CES2 (1.00) LMNACES2CES1TDP1L3MBTL1
Benzoin SCHEMBL145 0.65 CES2 (1.00) LMNACES2CES1TDP1L3MBTL1
Benzoin SCHEMBL2025536 0.65 CES2 (1.00) LMNACES2CES1TDP1L3MBTL1
Benzoin SCHEMBL27696284 0.65 CES2 (1.00) LMNACES2CES1TDP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070219292-A1 INK SET FOR INK-JET RECORDING, POLYMERIZATION METHOD AND IMAGE FORMING METHOD KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-09-20 US disclosed