SCHEMBL3235713

SCHEMBL3235713

C[SiH](C)OC(C(=O)O)c1cccc(C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RXRA P19793 2/20 0.43
▸ RXRB P28702 2/20 0.43
▸ ACHE P22303 3/20 0.41
▸ HDAC8 Q9BY41 2/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC2 Q92769 1/20 0.38
▸ PPARG P37231 4/20 0.36
▸ BCHE P06276 3/20 0.36
▸ CTSA P10619 1/20 0.36
▸ NOTUM Q6P988 1/20 0.35
▸ PTGS1 P23219 1/20 0.34
▸ HDAC3 O15379 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ PPARA Q07869 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
SCHEMBL4677052 0.78 HDAC8 (0.39) RXRARXRBACHEHDAC8HDAC4
SCHEMBL6771920 0.75 HDAC4 (0.35) RXRARXRBACHEHDAC8HDAC4
SCHEMBL23972306 0.74 LMNA (0.53) RXRARXRBACHEHDAC8HDAC4
SCHEMBL7357616 0.74 PTGS1 (0.56) RXRARXRBACHEHDAC8HDAC4
SCHEMBL1788079 0.74 IDO1 (0.45) RXRARXRBACHEHDAC8HDAC4
SCHEMBL16019037 0.73 ACHE (0.46) RXRARXRBACHEHDAC8HDAC4
SCHEMBL28988616 0.73 ACHE (0.46) RXRARXRBACHEHDAC8HDAC4
SCHEMBL1787675 0.72 ACHE (0.45) RXRARXRBACHEHDAC8HDAC4
SCHEMBL5871219 0.72 PNMT (0.42) RXRARXRBACHEHDAC8HDAC4
SCHEMBL1787680 0.71 ACHE (0.44) RXRARXRBACHEHDAC8HDAC4

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
WO-2010024422-A1 AMIDE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 — — WO disclosed
WO-2010024365-A1 AMIDE COMPOUNDS AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-03-04 — — WO disclosed
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