SCHEMBL7776174

SCHEMBL7776174

O=C(Nc1ccccc1)Nc1ccc(C(=O)NS(=O)(=O)c2ccccc2O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT1 Q96EB6 2/20 0.54
POLB P06746 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
PTGES O14684 1/20 0.50
HIF1A Q16665 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
MAPT P10636 1/20 0.49
TAAR1 Q96RJ0 1/20 0.49
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
KDM4E B2RXH2 1/20 0.48
CTDSP1 Q9GZU7 1/20 0.48
TDP1 Q9NUW8 1/20 0.48

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
SCHEMBL7776171 0.86 PTGES (0.44) SIRT1POLBMEN1KMT2ACA12
SCHEMBL7774539 0.83 SIRT1 (0.50) SIRT1POLBMEN1KMT2ACA12
SCHEMBL6295675 0.82 SIRT1 (0.60) SIRT1POLBMEN1KMT2ACA12
SCHEMBL7776312 0.81 MAOA (0.61) SIRT1POLBMEN1KMT2ACA12
SCHEMBL7770072 0.81 MAOA (0.61) SIRT1POLBMEN1KMT2ACA12
SCHEMBL7776309 0.80 LMNA (0.42) POLBMEN1KMT2ACA12CA1
SCHEMBL6295620 0.80 MEN1 (0.65) SIRT1MEN1KMT2ACA12CA1
SCHEMBL8767375 0.79 CA2 (0.42) POLBMEN1KMT2ACA12CA1
SCHEMBL7774521 0.77 LMNA (0.74) MEN1KMT2ACA12CA1CA2
SCHEMBL7647250 0.77 LMNA (0.74) MEN1KMT2ACA12CA1CA2

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
EP-0788889-B1 A thermal sensitive recording sheet JUJO PAPER CO LTD (JP) 2001-08-08 EP disclosed
EP-0788889-A2 A thermal sensitive recording sheet NIPPON PAPER INDUSTRIES CO., LTD. (JP) 1997-08-13 EP disclosed