SCHEMBL7212819

SCHEMBL7212819

COc1ccccc1CC(=O)c1ccc(C(C)C)[c]c1C(C)C

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.53
HIF1A Q16665 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.42
CNR2 P34972 1/20 0.42
ATM Q13315 1/20 0.41
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 1/20 0.38

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
SCHEMBL7207810 0.79 SMN1; SMN2 (0.41) TTRATMHPGDHTTMAPT
SCHEMBL7206388 0.79 TSHR (0.41) HIF1AL3MBTL1CNR2HPGDHTT
SCHEMBL7212823 0.78 L3MBTL1 (0.50) TTRL3MBTL1HPGDHTTMEN1
SCHEMBL7206345 0.75 GABRA1 (0.41) HIF1AHPGDMEN1TSHRKMT2A
SCHEMBL332837 0.75 TTR (0.66) TTRHIF1AL3MBTL1CNR2ATM
SCHEMBL236891 0.72 TTR (0.70) TTRHIF1AL3MBTL1CNR2ATM
SCHEMBL758911 0.71 TTR (0.61) TTRHIF1AL3MBTL1CNR2ATM
SCHEMBL1246697 0.70 RAB9A (0.65) TTRHIF1AL3MBTL1HPGDHTT
SCHEMBL800460 0.70 HPGD (0.54) TTRATMHPGDHTTMAPT
SCHEMBL710329 0.70 LMNA (0.56) TTRL3MBTL1ATMMAPTMEN1

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-0841913-B1 USE OF SULFAMIC ACID DERIVATIVES, ACYL SULFONAMIDES OR SULFONYL CARBAMATES FOR THE MANUFACTURE OF A MEDICAMENT FOR LOWERING LIPOPROTEIN LEVELS WARNER LAMBERT CO (US) 2003-02-05 EP claimed
US-5633287-A N-acyl sulfamic acid esters (or thioesters), N-acyl sulfonamides, and n-sulfonyl carbamic acid esters (or thioesters) as hypercholesterolemic agents WARNER-LAMBERT COMPANY (US) 1997-05-27 US disclosed