SCHEMBL7207814

SCHEMBL7207814

COc1cc(OC)c(CC(=O)c2cc(C(C)C)[c]c(C(C)C)c2)c(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.39
LMNA P02545 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
RAB9A P51151 1/20 0.37
CYP3A4 P08684 2/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTPN1 P18031 1/20 0.36
PDE4D Q08499 1/20 0.36
USP2 O75604 1/20 0.35
MAPK1 P28482 1/20 0.35
ABCG2 Q9UNQ0 1/20 0.35

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
SCHEMBL8701445 0.80 HSD17B10 (0.56) NPC1LMNAHTTSMN1; SMN2RAB9A
SCHEMBL7207810 0.78 SMN1; SMN2 (0.41) NPC1LMNAHTTSMN1; SMN2RAB9A
SCHEMBL7212823 0.77 L3MBTL1 (0.50) NPC1HTTRAB9ACYP3A4CYP2D6
SCHEMBL7206347 0.72 GABRA1 (0.43) LMNASMN1; SMN2CYP3A4
SCHEMBL32679613 0.72 MEN1 (0.48) NPC1LMNAHTTSMN1; SMN2RAB9A
SCHEMBL32679611 0.72 MEN1 (0.48) NPC1LMNAHTTSMN1; SMN2RAB9A
SCHEMBL4573904 0.71 ALDH1A1 (0.48) CYP3A4CYP2D6CYP2C19
SCHEMBL1599400 0.70 HSD17B10 (0.56) LMNASMN1; SMN2CYP3A4PTPN1USP2
SCHEMBL29043392 0.69 PTPN1 (0.45) SMN1; SMN2CYP3A4PTPN1USP2MAPK1
SCHEMBL6201398 0.69 PTPN1 (0.45) NPC1LMNAHTTSMN1; SMN2CYP3A4

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
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