SCHEMBL9521922

SCHEMBL9521922

COC(=O)c1ccc(CO[SiH2]C(C)(C)C(C)C)nc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.44
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 1/20 0.36
MAPT P10636 3/20 0.36
ALDH1A1 P00352 1/20 0.35
RAB9A P51151 2/20 0.35
GAA P10253 1/20 0.35
NPC1 O15118 1/20 0.35
KMT2A Q03164 1/20 0.35
GABRA5 P31644 2/20 0.34
HCAR3 P49019 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL9521084 0.83 KDM4E (0.32) KDM4EL3MBTL1ALDH1A1GAAKMT2A
SCHEMBL1439028 0.76 MAPK1 (0.59) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL8682205 0.75 MAPK1 (0.50) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL30792011 0.75 MAPK1 (0.50) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL31435350 0.74 MAPK1 (0.56) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL3759509 0.73 MAPK1 (0.46) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL480126 0.73 MAPK1 (0.59) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL2382926 0.73 MAPK1 (0.54) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL17893894 0.73 MAPK1 (0.58) MAPK1KDM4EL3MBTL1CA12CA1
SCHEMBL3715093 0.73 MAPK1 (0.54) MAPK1KDM4EL3MBTL1CA12CA1

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 5 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
WO-1991003474-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1991-03-21 WO disclosed
WO-1989008651-A1 HYPOGLYCEMIC THIAZOLIDINEDIONE DERIVATIVES PFIZER INC. (US) 1989-09-21 WO disclosed