SCHEMBL8747773

SCHEMBL8747773

Cc1cc(O)c(C)c2c1OC(C)(CCN(C)C)CC2

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 14/20 0.56
AKT1 P31749 3/20 0.44
PDPK1 O15530 1/20 0.44
PHLPP1 O60346 1/20 0.44
ILK Q13418 1/20 0.44
MAPT P10636 2/20 0.40
LMNA P02545 2/20 0.40
MEN1 O00255 1/20 0.40
GSTP1 P09211 1/20 0.40
TTPA P49638 1/20 0.40
KMT2A Q03164 1/20 0.40
USP2 O75604 1/20 0.40
THRB P10828 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL8600009 0.85 ALOX5 (0.62) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL6028033 0.82 ALOX5 (0.58) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL6463246 0.82 ALOX5 (0.58) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL6027939 0.82 ALOX5 (0.58) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL8746297 0.82 ALOX5 (0.56) ALOX5AKT1PDPK1PHLPP1ILK
Bromide SCHEMBL8599204 0.81 ALOX5 (0.56) ALOX5AKT1PDPK1PHLPP1ILK
Bromide SCHEMBL9096621 0.81 ALOX5 (0.55) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL4643458 0.81 ALOX5 (0.66) ALOX5
SCHEMBL8747826 0.81 AKT1 (0.66) ALOX5AKT1PDPK1PHLPP1ILK
SCHEMBL8747784 0.80 MAPT (0.59) ALOX5MAPTLMNAMEN1GSTP1

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0586518-B1 CHOLESTEROL-LOWERING TOCOPHEROL ANALOGS MERRELL PHARMA INC (US) 1997-03-12 EP claimed
US-5135945-A Cholesterol-lowering tocopherol analogs MERRELL DOW PHARMACEUTICALS INC. (US) 1992-08-04 US claimed
EP-0586518-B1 CHOLESTEROL-LOWERING TOCOPHEROL ANALOGS MERRELL PHARMA INC (US) 1997-03-12 EP disclosed
EP-0369874-B1 Cardioprotective tocopherol analogs MERRELL DOW PHARMA (US) 1995-02-22 EP disclosed
EP-0586518-A1 CHOLESTEROL-LOWERING TOCOPHEROL ANALOGS. MERRELL DOW PHARMA (US) 1994-03-16 EP disclosed
WO-1992021336-A1 CHOLESTEROL-LOWERING TOCOPHEROL ANALOGS MERRELL DOW PHARMACEUTICALS INC. (US) 1992-12-10 WO disclosed
US-5135945-A Cholesterol-lowering tocopherol analogs MERRELL DOW PHARMACEUTICALS INC. (US) 1992-08-04 US disclosed
EP-0369874-A2 Cardioprotective tocopherol analogs MERRELL DOW PHARMACEUTICALS INC. (US) 1990-05-23 EP disclosed
EP-0369082-A1 Cardioprotective tocopherol analogs MERRELL DOW PHARMACEUTICALS INC. (US) 1990-05-23 EP disclosed