SCHEMBL28989968

SCHEMBL28989968

CC1CCC(=O)CC1.[N-]=[N+]=Nc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 4/20 0.41
▸ SMO Q99835 2/20 0.40
▸ CYP2C19 P33261 2/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ RIPK1 Q13546 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ CA5A P35218 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ CA5B Q9Y2D0 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ GFER P55789 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ SRD5A1 P18405 1/20 0.32
▸ SRD5A2 P31213 1/20 0.32
▸ ACHE P22303 1/20 0.32

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
SCHEMBL28840266 0.83 CA1 (0.35) PTGS2SMOCA1CA2CA5A
SCHEMBL29112201 0.83 L3MBTL1 (0.44) PTGS2SMOCYP2C19CYP2D6NPC1
Cyclohexanone SCHEMBL28839585 0.80 PTGS2 (0.45) PTGS2SMOCYP2C19CYP2D6NPC1
SCHEMBL15259665 0.77 SLC6A3 (0.31) SMOCA1CA2CA5ACA9
SCHEMBL13475909 0.74 — —
Benzene SCHEMBL28456073 0.74 PTGS2 (0.48) PTGS2SMOCYP2C19CYP2D6ALDH1A1
Cyclohexane SCHEMBL29035562 0.72 PTGS2 (0.49) PTGS2SMOCYP2C19CYP2D6ALDH1A1
Formaldehyde SCHEMBL27489743 0.72 CA1 (0.47) PTGS2SMOCYP2C19CYP2D6ALDH1A1
SCHEMBL17289458 0.72 PTGS2 (0.47) PTGS2SMOCYP2C19CYP2D6ALDH1A1
Phosphine SCHEMBL29065184 0.72 PTGS2 (0.47) PTGS2SMOCYP2C19CYP2D6ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117111405-A Preparation of linear polysiloxane low dielectric loss photosensitive resin and application of photoetching patterning 西南科技大学 2023-11-24 — — CN claimed
CN-115785455-B Polyphosphate film-forming resin and photoresist composition 广东粤港澳大湾区黄埔材料研究院 2023-10-10 — — CN claimed
CN-115197664-B Optical adhesive composition, optical adhesive film and method for producing optical adhesive film 业成科技(成都)有限公司 2023-06-02 — — CN claimed
CN-116075201-A Preparation method of patterned hole semiconductor layer and photoelectric device 宁波杭州湾新材料研究院 2023-05-05 — — CN claimed
CN-118046659-A Lithographic printing plate precursor, method for producing lithographic printing plate, and lithographic printing method 富士胶片株式会社 2024-05-17 — — CN disclosed
CN-114072290-B On-press development type lithographic printing plate precursor, method for producing lithographic printing plate, and lithographic printing method 富士胶片株式会社 2024-04-30 — — CN disclosed
CN-117916096-A On-press development type lithographic printing plate precursor, method for producing lithographic printing plate, and lithographic printing method 富士胶片株式会社 2024-04-19 — — CN disclosed
CN-117881548-A Laminate body 富士胶片株式会社 2024-04-12 — — CN disclosed
CN-117881547-A On-press development type lithographic printing plate precursor and method for producing printing plate 富士胶片株式会社 2024-04-12 — — CN disclosed
CN-114450161-B Lithographic printing plate precursor, method for producing lithographic printing plate, and lithographic printing method 富士胶片株式会社 2024-04-02 — — CN disclosed
CN-117716291-A Photosensitive conductive paste, method for producing base material with conductive pattern, method for producing electronic component, cured film, fired body, and electronic component 东丽株式会社 2024-03-15 — — CN disclosed
CN-117678039-A Electrode composition for electrospray 阿莫绿色技术有限公司 2024-03-08 — — CN disclosed
CN-109716491-B Method for manufacturing field effect transistor and method for manufacturing wireless communication device 东丽株式会社 2023-06-09 — — CN disclosed
CN-115197664-B Optical adhesive composition, optical adhesive film and method for producing optical adhesive film 业成科技(成都)有限公司 2023-06-02 — — CN disclosed
CN-116157262-A Oxygen-blocking cycloolefin resin cured product RIMTEC株式会社 2023-05-23 — — CN disclosed
CN-116137900-A Photosensitive conductive paste, cured product, fired body, electronic component, method for producing insulating ceramic layer with circuit pattern, method for producing electronic component, method for producing substrate with circuit pattern, and method for producing inductor 东丽株式会社 2023-05-19 — — CN disclosed
CN-116133862-A On-press development type lithographic printing plate precursor, method for producing lithographic printing plate, and lithographic printing method 富士胶片株式会社 2023-05-16 — — CN disclosed
CN-116075201-A Preparation method of patterned hole semiconductor layer and photoelectric device 宁波杭州湾新材料研究院 2023-05-05 — — CN disclosed
CN-108292630-B Ferroelectric memory element, method for manufacturing the same, memory cell using the same, and wireless communication device using the same 东丽株式会社 2023-04-25 — — CN disclosed
CN-115621420-A Electrode manufacturing apparatus, energy storage device manufacturing apparatus, liquid discharge apparatus, electrode manufacturing method, and recording medium 株式会社理光 2023-01-17 — — CN disclosed
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