SCHEMBL10558657

SCHEMBL10558657

CCCCCCc1cccc2c1Oc1ccccc1N2[Si](C)(C)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 1/20 0.40
▸ NR1H3 Q13133 1/20 0.40
▸ LIPG Q9Y5X9 1/20 0.37
▸ CYP1A1 P04798 1/20 0.34
▸ KCNH2 Q12809 1/20 0.33
▸ BID P55957 3/20 0.33
▸ MCL1 Q07820 3/20 0.33
▸ BCL2L1 Q07817 2/20 0.33
▸ BAK1 Q16611 2/20 0.33
▸ KAT8 Q9H7Z6 2/20 0.33
▸ PPARG P37231 1/20 0.33
▸ PPARA Q07869 1/20 0.33
▸ EP300 Q09472 1/20 0.33
▸ KAT2A Q92830 1/20 0.33
▸ KAT2B Q92831 1/20 0.33
▸ KAT5 Q92993 1/20 0.33
▸ SAE1 Q9UBE0 1/20 0.33
▸ ALOX5 P09917 1/20 0.32
▸ PTGS2 P35354 1/20 0.32
▸ TLR8 Q9NR97 1/20 0.31

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
SCHEMBL10560185 0.91 NR1H2 (0.41) NR1H2NR1H3LIPGKCNH2BID
SCHEMBL18153979 0.74 LIPG (0.49) NR1H2NR1H3LIPGCYP1A1KCNH2
SCHEMBL29432879 0.74 LIPG (0.49) NR1H2NR1H3LIPGCYP1A1KCNH2
SCHEMBL7054345 0.74 LIPG (0.49) NR1H2NR1H3LIPGCYP1A1KCNH2
SCHEMBL10560178 0.74 P2RX4 (0.41) —
SCHEMBL10560990 0.73 NR1H2 (0.39) NR1H2NR1H3LIPGCYP1A1BID
SCHEMBL28222763 0.73 LIPG (0.46) NR1H2NR1H3LIPGCYP1A1KCNH2
SCHEMBL27483096 0.68 MTNR1A (0.41) LIPGCYP1A1BIDMCL1BCL2L1
SCHEMBL30083982 0.67 LIPG (0.42) NR1H2NR1H3LIPGCYP1A1KCNH2
SCHEMBL21437083 0.67 LIPG (0.42) NR1H2NR1H3LIPGCYP1A1KCNH2

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
US-4803269-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1989-02-07 — — US disclosed
US-4707473-A ANTIINFLAMMATORY AGENTS SYNTEX (U.S.A.) INC. (US) 1987-11-17 — — US disclosed
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