SCHEMBL2830601

SCHEMBL2830601

CCCCCCCCc1csc(CCCCCCCC)c1CCCCCCCC

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 5/20 0.41
TYR P14679 2/20 0.40
LIPG Q9Y5X9 1/20 0.38
ALOX5 P09917 8/20 0.37
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PTGS2 P35354 3/20 0.37
HTR2A P28223 1/20 0.35

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
SCHEMBL3331501 1.00 GPR35 (0.41) GPR35TYRLIPGALOX5MEN1
SCHEMBL28681510 1.00 GPR35 (0.41) GPR35TYRLIPGALOX5MEN1
SCHEMBL8564899 0.92 HTT (0.35) GPR35TYRMAPTHTT
Tetrahydrofuran SCHEMBL29110538 0.87 GPR35 (0.35) GPR35TYRLIPGALOX5KMT2A
Chlorobenzene SCHEMBL29110540 0.86 LIPG (0.40) GPR35TYRLIPG
Anisole SCHEMBL29110539 0.85 CNR2 (0.42) GPR35LIPGALOX5CYP3A4HTT
SCHEMBL27942088 0.83 GPR35 (0.45) GPR35TYR
SCHEMBL27953945 0.82 GPR35 (0.44) GPR35TYRALOX5
SCHEMBL27843104 0.81 GPR35 (0.49) GPR35ALOX5TP53CYP3A4PTGS2
SCHEMBL27841909 0.81 GPR35 (0.49) GPR35ALOX5TP53CYP3A4PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116649008-A Preparation method of light-emitting device, light-emitting device and light-emitting device 京东方科技集团股份有限公司 2023-08-25 CN claimed
CN-109796812-B Quantum dot dispersion liquid for ink-jet printing and color film 苏州星烁纳米科技有限公司 2023-01-17 CN claimed
CN-116649008-A Preparation method of light-emitting device, light-emitting device and light-emitting device 京东方科技集团股份有限公司 2023-08-25 CN disclosed
US-20230204533-A1 THERMOPLASTIC ELECTRODES FOR POTENTIOMETRIC DETECTION OF IONS COLORADO STATE UNIVERSITY RESEARCH FOUNDATION (US) 2023-06-29 US disclosed
CN-109796812-B Quantum dot dispersion liquid for ink-jet printing and color film 苏州星烁纳米科技有限公司 2023-01-17 CN disclosed
US-20100078067-A1 CARBON NANOTUBE FILM BASED SOLAR CELL AND FABRICATING METHOD THEREOF TSINGHUA UNIVERSITY (CN) 2010-04-01 US disclosed