SCHEMBL7984777

SCHEMBL7984777

Cc1c2ccccc2c(COS(=O)(=O)O)c2ccc3ccccc3c12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.51
HPGD P15428 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.51
HIF1A Q16665 2/20 0.51
HSD17B10 Q99714 2/20 0.51
RAB9A P51151 2/20 0.51
TSHR P16473 2/20 0.51
MAPK1 P28482 1/20 0.51
CASP1 P29466 1/20 0.51
CASP7 P55210 1/20 0.51
ATM Q13315 1/20 0.51
TP53 P04637 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 1/20 0.35
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
NPC1 O15118 1/20 0.34
SLC2A1 P11166 4/20 0.34

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
SCHEMBL7998255 0.85 HSP90AA1 (0.33) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
SCHEMBL7998258 0.82 HSP90AA1 (0.33) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
Sulfuric Acid SCHEMBL7984779 0.82 HPGD (0.56) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
SCHEMBL19065044 0.73 L3MBTL1 (0.65) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
SCHEMBL7994830 0.72 CYP1A2 (0.39) HPGDHIF1AHSD17B10TSHRCYP1A2
SCHEMBL29403351 0.70 HSD17B10 (1.00) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
SCHEMBL99213 0.70 HSD17B10 (1.00) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
SCHEMBL29531544 0.70 HSD17B10 (1.00) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
SCHEMBL29382459 0.70 HSD17B10 (1.00) CYP3A4HPGDL3MBTL1HIF1AHSD17B10
Acetone SCHEMBL4624685 0.70 HPGD (0.81) CYP3A4HPGDL3MBTL1HIF1AHSD17B10

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-6294380-B1 Liver cell clones for use in extracorporeal liver-assist device JMS CO., LTD. (JP) 2001-09-25 US disclosed
EP-1063289-A1 Liver cell clones for artifical liver and extracorporeal liver assist device JMS Co., Ltd. (JP) 2000-12-27 EP disclosed