SCHEMBL6697531

SCHEMBL6697531

CCCCO[Si](OCCCC)(OCCCC)c1ccccc1N

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.53
CYP2C9 P11712 2/20 0.53
CYP2C19 P33261 2/20 0.53
ALDH1A1 P00352 3/20 0.45
HSD17B10 Q99714 2/20 0.45
TLR8 Q9NR97 3/20 0.40
KDM4E B2RXH2 2/20 0.40
POLB P06746 1/20 0.40
LTA4H P09960 2/20 0.38
MCHR1 Q99705 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP19A1 P11511 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
PKM P14618 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
SCHEMBL61764 0.89 CYP1A2 (0.43) CYP1A2CYP2C9CYP2C19ALDH1A1HSD17B10
SCHEMBL974499 0.87 LTA4H (0.44) CYP1A2CYP2C9CYP2C19ALDH1A1HSD17B10
SCHEMBL62857 0.81 ALDH1A1 (0.45) CYP1A2CYP2C9CYP2C19ALDH1A1HSD17B10
SCHEMBL5549263 0.80 LTA4H (0.39) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL728144 0.79 LTA4H (0.38) CYP1A2CYP2C9CYP2C19ALDH1A1HSD17B10
SCHEMBL16536448 0.76 HTR1B (0.43) CYP2C9TLR8MCHR1TDP1L3MBTL1
SCHEMBL23493441 0.75 LTA4H (0.35) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL29434675 0.75 LTA4H (0.35) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL430189 0.74 ALDH1A1 (0.38) CYP1A2CYP2C9CYP2C19ALDH1A1TLR8
SCHEMBL9001096 0.74 TSHR (0.40) ALDH1A1HSD17B10TLR8KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111886278-A Triazine ring-containing polymer, resin composition, cured film, and solid-state imaging element 东丽株式会社 2020-11-03 CN disclosed
WO-2019188475-A1 TRIAZINE-RING-CONTAINING POLYMER, RESIN COMPOSITION, CURED FILM, AND SOLID-STATE IMAGING ELEMENT 東レ株式会社 2019-10-03 WO disclosed
US-20040197484-A1 Coating liquid for forming insulating film and method for producing insulating film SUMITOMO CHEMICAL COMPANY, LIMITED 2004-10-07 US disclosed