SCHEMBL9204460

SCHEMBL9204460

CNc1ccc2c(c1)OC(=Cc1ccc(O)c(C(C)(C)C)c1)C2=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STK17B O94768 10/20 0.54
MEN1 O00255 6/20 0.54
KMT2A Q03164 6/20 0.54
RECQL P46063 4/20 0.54
MAOA P21397 3/20 0.54
AURKA O14965 3/20 0.54
GSK3B P49841 3/20 0.54
KDM4E B2RXH2 2/20 0.54
NPC1 O15118 2/20 0.54
GAA P10253 2/20 0.54
MAPT P10636 2/20 0.54
DAPK3 O43293 2/20 0.54
BLK P51451 2/20 0.54
CDK5 Q00535 2/20 0.54
TEK Q02763 2/20 0.54
BTK Q06187 2/20 0.54
ITK Q08881 2/20 0.54
STK17A Q9UEE5 2/20 0.54
DAPK2 Q9UIK4 2/20 0.54
PSMD14 O00487 1/20 0.54

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
SCHEMBL30692076 0.74 MEN1 (0.73) STK17BMEN1KMT2ARECQLMAOA
SCHEMBL30692068 0.74 MEN1 (0.73) STK17BMEN1KMT2ARECQLMAOA
Sulfuretin SCHEMBL30214394 0.71 MEN1 (1.00) STK17BMEN1KMT2ARECQLMAOA
Sulfuretin SCHEMBL634006 0.71 MEN1 (1.00) STK17BMEN1KMT2ARECQLMAOA
Sulfuretin SCHEMBL8346701 0.71 MEN1 (1.00) STK17BMEN1KMT2ARECQLMAOA
Sulfuretin SCHEMBL634007 0.71 MEN1 (1.00) STK17BMEN1KMT2ARECQLMAOA
Sulfuretin SCHEMBL29545005 0.71 MEN1 (1.00) STK17BMEN1KMT2ARECQLMAOA
Sulfuretin SCHEMBL30214408 0.71 MEN1 (1.00) STK17BMEN1KMT2ARECQLMAOA
SCHEMBL22667800 0.70 STK17B (0.65) STK17BMEN1KMT2ARECQLMAOA
SCHEMBL6964950 0.70 MEN1 (0.78) STK17BMEN1KMT2ARECQLMAOA

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-0634927-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1995-01-25 EP disclosed
WO-1993017671-A1 TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES, OR BACTERIA STATENS SERUMINSTITUT (DK) 1993-09-16 WO disclosed