SCHEMBL20044993

SCHEMBL20044993

CCCCCCc1cccc2c1ccc1c3cc(C#C[Si](C(C)C)(C(C)C)C(C)C)c4c5cccc(CCCCCC)c5ccc4c3cc(C#C[Si](C)(C(C)C)C(C)C)c21

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 7/20 0.35
LIPG Q9Y5X9 1/20 0.31
KCNH2 Q12809 1/20 0.30
BID P55957 3/20 0.30
MCL1 Q07820 3/20 0.30
BCL2L1 Q07817 2/20 0.30
BAK1 Q16611 2/20 0.30
KAT8 Q9H7Z6 2/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
EP300 Q09472 1/20 0.30
KAT2A Q92830 1/20 0.30
KAT2B Q92831 1/20 0.30
KAT5 Q92993 1/20 0.30
SAE1 Q9UBE0 1/20 0.30

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
SCHEMBL20044986 0.91 TLR8 (0.30) TLR8
SCHEMBL20044980 0.88 TLR8 (0.36) TLR8LIPGKCNH2
SCHEMBL16807715 0.67 TLR8 (0.43) TLR8LIPGBIDMCL1BCL2L1
SCHEMBL4586339 0.66 CACNA2D1 (0.36)
SCHEMBL5346129 0.64 ALOX5 (0.49) LIPGKCNH2BIDMCL1BCL2L1
SCHEMBL10058019 0.64 TLR8 (0.35) TLR8KCNH2
SCHEMBL21196907 0.63 SKP2 (0.42) KAT8
SCHEMBL28434207 0.63 LIPG (0.55) TLR8LIPGKCNH2BIDMCL1
SCHEMBL5348955 0.62 ALOX5 (0.50) LIPGKCNH2BIDMCL1BCL2L1
SCHEMBL30537736 0.62 LIPG (0.57) LIPGKCNH2BIDMCL1BCL2L1

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-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed
US-20180102222-A1 PHOTOELECTRIC CONVERSION ELEMENT, AND SOLAR CELL USING THE SAME FUJIFILM CORPORATION (JP) 2018-04-12 US disclosed