SCHEMBL9521091

SCHEMBL9521091

CC(C)(C)OC(=O)CC(=O)c1ccc(CO[Si](C)(C)C(C)(C)C)nc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 2/20 0.36
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
BACE1 P56817 1/20 0.33
HDAC1 Q13547 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
PTPRC P08575 2/20 0.32
NAMPT P43490 2/20 0.32
CCNB2 O95067 1/20 0.32
CCNE2 O96020 1/20 0.32
CDK1 P06493 1/20 0.32
CDK4 P11802 1/20 0.32
CCNB1 P14635 1/20 0.32
CCND1 P24385 1/20 0.32

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
SCHEMBL30792011 0.80 MAPK1 (0.50) GABRA5KDM4EALDH1A1GAAKMT2A
SCHEMBL8682205 0.80 MAPK1 (0.50) GABRA5KDM4EALDH1A1GAAKMT2A
SCHEMBL8545215 0.80 MAPT (0.46) GABRA5ALDH1A1L3MBTL1
SCHEMBL507626 0.80 HRH3 (0.34) ALDH1A1BACE1HDAC1HDAC8HDAC6
SCHEMBL9521084 0.79 KDM4E (0.32) GABRA5KDM4EALDH1A1MEN1GAA
SCHEMBL29209521 0.78 GRIN2B (0.41) GABRA5KDM4EALDH1A1GRIN2B
SCHEMBL20483548 0.76 HDAC6 (0.38) L3MBTL1HDAC1HDAC8HDAC6HDAC5
SCHEMBL29209494 0.76 GAA (0.51) ALDH1A1MEN1GAAKMT2AL3MBTL1
SCHEMBL8681688 0.75 NPC1 (0.38) ALDH1A1MEN1GAAKMT2A
SCHEMBL3150948 0.74 BACE1 (0.33) BACE1HDAC1HDAC8HDAC6HDAC5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0332332-B1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1993-03-31 EP disclosed
US-5130379-A Anticholesterol agents and antidiabetic agents PFIZER INC. (US) 1992-07-14 US disclosed
US-5036079-A Anticholesterol PFIZER INC. (US) 1991-07-30 US disclosed
EP-0332332-A1 Hypoglycemic thiazolidinedione derivatives PFIZER INC. (US) 1989-09-13 EP disclosed