SCHEMBL66102

SCHEMBL66102

C=C1CCc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 1/20 0.54
MAOB P27338 2/20 0.43
CYP2A6 P11509 1/20 0.43
MAOA P21397 1/20 0.43
SETD7 Q8WTS6 1/20 0.42
NOS3 P29474 1/20 0.40
NOS2 P35228 1/20 0.40
PDPK1 O15530 1/20 0.40
PARP1 P09874 1/20 0.40
PARP10 Q53GL7 1/20 0.40
PARP11 Q9NR21 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.39
SRD5A1 P18405 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
SRD5A2 P31213 1/20 0.39
TSHR P16473 1/20 0.39
NOTUM Q6P988 1/20 0.39
HPGD P15428 1/20 0.39
CYP19A1 P11511 2/20 0.38
CYP11B2 P19099 2/20 0.38

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
SCHEMBL29370260 1.00 CES1 (0.54) CES1MAOBCYP2A6MAOASETD7
SCHEMBL29795286 0.85 CYP2A6 (0.56) CES1MAOBCYP2A6MAOANOS3
SCHEMBL29795287 0.85 CYP2A6 (0.56) CES1MAOBCYP2A6MAOANOS3
SCHEMBL6691916 0.85 TSHR (0.55) CES1MAOBCYP2A6MAOANOS3
SCHEMBL11327557 0.85 CES1 (0.50) CES1MAOBCYP2A6MAOASETD7
SCHEMBL1822219 0.85 CYP2A6 (0.56) CES1MAOBCYP2A6MAOANOS3
SCHEMBL6006940 0.83 MEN1 (0.39) CES1MAOBCYP2A6MAOASETD7
SCHEMBL1739155 0.81 CES1 (0.71) CES1MAOBCYP2A6MAOAPDPK1
SCHEMBL30303760 0.81 CES1 (0.71) CES1MAOBCYP2A6MAOAPDPK1
SCHEMBL4039247 0.81 CES1 (0.56) CES1MAOBCYP2A6MAOASETD7

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 304 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12595356-B2 Composite particle and use thereof in optical filtration COLOURSMITH LABS INC. (CA) 2026-04-07 US claimed
CN-114207050-B Composite particles comprising a hydrophobic dye and an amphiphilic block copolymer and their use in optical applications 史密斯实验室公司 2024-12-13 CN claimed
US-12116468-B2 Composite particles comprising a hydrophobic dye and an amphiphilic block copolymer and use thereof in optical applications COLOURSMITH LABS INC. (CA) 2024-10-15 US claimed
CN-117659065-A Method for preparing beta-boron-substituted aldehyde derivative 中国科学院大连化学物理研究所 2024-03-08 CN claimed
US-20240026127-A1 COMPOSITE PARTICLE AND USE THEREOF IN OPTICAL FILTRATION COLOURSMITH LABS INC. (CA) 2024-01-25 US claimed
EP-4255983-A1 COMPOSITE PARTICLE AND USE THEREOF IN OPTICAL FILTRATION Coloursmith Labs Inc. (CA) 2023-10-11 EP claimed
US-20220235197-A1 COMPOSITE PARTICLES COMPRISING A HYDROPHOBIC DYE AND AN AMPHIPHILIC BLOCK COPOLYMER AND USE THEREOF IN OPTICAL APPLICATIONS COLOURSMITH LABS INC. (CA) 2022-07-28 US claimed
WO-2022115948-A1 COMPOSITE PARTICLE AND USE THEREOF IN OPTICAL FILTRATION COLOURSMITH LABS INC. (CA) 2022-06-09 WO claimed
US-11327400-B2 Patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2022-05-10 US claimed
EP-3976715-A1 COMPOSITE PARTICLES COMPRISING A HYDROPHOBIC DYE AND AN AMPHIPHILIC BLOCK COPOLYMER AND USE THEREOF IN OPTICAL APPLICATIONS Coloursmith Labs Inc. (CA) 2022-04-06 EP claimed
CN-114207050-A Composite particles comprising a hydrophobic dye and an amphiphilic block copolymer and their use in optical applications 史密斯实验室公司 2022-03-18 CN claimed
US-7473669-B2 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones, and their use as fungicides DOW AGROSCIENCES LLC (US) 2009-01-06 US claimed
EP-1881966-A2 SUBSTITUTED 4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONES, 1,2,4-TRIANZIN-6-ONES, AND THEIR USE AS FUNGICIDES Dow AgroSciences LLC (US) 2008-01-30 EP claimed
WO-2006119400-A2 SUBSTITUTED 4,5-DIHYDRO-1,2,4-TRIAZIN-6-ONES, 1,2,4-TRIANZIN-6-ONES, AND THEIR USE AS FUNGICIDES DOW AGROSCIENCES LLC (US) 2006-11-09 WO claimed
US-20060252755-A1 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones, and their use as fungicides DOW AGROSCIENCES LLC 2006-11-09 US claimed
CN-116560190-B Resist material and pattern forming method SHIN-ETSU CHEMICAL CO., LTD. (JP) 2026-05-26 CN disclosed
US-12595356-B2 Composite particle and use thereof in optical filtration COLOURSMITH LABS INC. (CA) 2026-04-07 US disclosed
US-6372911-B1 REACTING COMPOUND CONTAINING AT LEAST ONE CARBON-CARBON DOUBLE BOND WITH CARBAMATE IN AQUEOUS SOLVENT IN PRESENCE OF BASE, OSMIUM CATALYST, CO-OXIDANT, AND OPTIONALLY ASYMMETRIC LIGAND, TO FORM REACTION MIXTURE CONTAINING BETA-HYDROXY CARBAMATE MERCK & CO., INC. 2002-04-16 US disclosed
US-4237306-A ELECTROPHILIC REACTIONS WITH ALKYL ARYL KETONES TO PRODUCE METHYL ARYL ALKANOATES EMERY INDUSTRIES, INC. (US) 1980-12-02 US disclosed
US-4067823-A Thallium(III) reagents supported on montmorillonite clay minerals and oxythallation processes for utilizing same EMERY INDUSTRIES, INC. (US) 1978-01-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060252755-A1 Substituted 4,5-dihydro-1,2,4-triazin-6-ones, 1,2,4-triazin-6-ones, and their use as fungicides DDT, CYP4B1, CYP4X1 CES1 684/4885MAOB 1525/4885CYP2A6 21/4885
US-12595356-B2 Composite particle and use thereof in optical filtration CHLSN, PPOX, AHR CES1 1640/4885MAOB 765/4885CYP2A6 960/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.