SCHEMBL28113968

SCHEMBL28113968

CCCCOc1ccccc1-c1ncncn1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.57
CYP2C19 P33261 3/20 0.57
CYP2C9 P11712 2/20 0.57
CYP19A1 P11511 1/20 0.57
PDE5A O76074 5/20 0.47
PDE4A P27815 3/20 0.47
PDE4B Q07343 3/20 0.47
PDE4C Q08493 3/20 0.47
PDE4D Q08499 3/20 0.47
PTGDR2 Q9Y5Y4 1/20 0.43
GCGR P47871 2/20 0.43
KDM4E B2RXH2 1/20 0.42
MCHR1 Q99705 1/20 0.41
TLR8 Q9NR97 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
CYP2D6 P10635 2/20 0.40
ADRB2 P07550 1/20 0.40
LTA4H P09960 1/20 0.40
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL27600953 0.94 CYP1A2 (0.51) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL30497724 0.87 CYP1A2 (0.57) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL29365709 0.84 CYP1A2 (0.62) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL17292882 0.84 CYP1A2 (0.62) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL28928070 0.84 CYP1A2 (0.62) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL7192118 0.84 NPSR1 (0.49) CYP1A2CYP2C19PDE5AKDM4EL3MBTL1
SCHEMBL28096916 0.81 CYP2D6 (0.44) CYP1A2CYP2C19CYP2C9CYP19A1GCGR
SCHEMBL10574605 0.80 PDE5A (0.58) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL9566557 0.78 CYP1A2 (0.56) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A
SCHEMBL5954057 0.77 PDE5A (0.39) CYP1A2CYP2C19CYP2C9CYP19A1PDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118344662-A Plastic film with strong mechanical property and preparation method thereof 安徽达钰新材料科技有限公司 2024-07-16 CN claimed
CN-118325329-A Nylon fiber master batch for purifying space environment and production process thereof 佛山市塑派科技有限公司 2024-07-12 CN claimed
CN-114425390-B Preparation method and application of 3D printing catalyst loaded with carbon quantum dots 南京师范大学 2024-07-09 CN claimed
CN-118271680-A Ultraviolet absorption anti-glare film and preparation method and application thereof 苏州诺菲纳米科技有限公司 2024-07-02 CN claimed
CN-118047993-A Polyolefin elastomer composition and application thereof in photovoltaic packaging film 广东众和工程设计有限公司 2024-05-17 CN claimed
CN-117887361-A Flexible foldable OCA optical cement and preparation method and application thereof 闽都创新实验室 2024-04-16 CN claimed
CN-114732749-B Ultraviolet and blue light resistant carbon quantum dot and preparation method and application thereof 广东碳紫科技有限公司 2024-03-19 CN claimed
CN-117701219-A Environment-friendly solvent-free low-temperature rapid-curing double-component polyurethane adhesive and preparation method thereof 广东普赛达密封粘胶有限公司 2024-03-15 CN claimed
CN-117659572-A Coffee grounds composite material, preparation method and application thereof 亚瀚材料科技(上海)有限公司 2024-03-08 CN claimed
CN-117624812-A Ultraviolet aging resistant polymer-based composite material and preparation method thereof 中国科学院化学研究所 2024-03-01 CN claimed
CN-112708114-B Low-dielectric high-light-transmittance polyarylate, polyarylate film and preparation method thereof 四川大学 2021-11-23 CN claimed
CN-110591557-B Organic silicon coating adhesive and preparation method thereof 杭州之江新材料有限公司 2021-05-18 CN claimed
CN-112708114-A Low-dielectric high-light-transmittance polyarylate, polyarylate film and preparation method thereof 四川大学 2021-04-27 CN claimed
CN-112457562-A Environment-friendly insulated cable and preparation method thereof 杭州富通电线电缆有限公司 2021-03-09 CN claimed
CN-110437428-B High-dyne-value active polyester, polyester film and preparation method thereof 四川大学 2020-12-18 CN claimed
CN-111763015-A Heating type graphene glass and preparation method thereof 长沙麓桥科技有限公司 2020-10-13 CN claimed
CN-111073584-A Single-component polyurethane sealant and low-temperature and rapid preparation method thereof 山东北方现代化学工业有限公司 2020-04-28 CN claimed
CN-110951450-A Special ultraviolet curing adhesive for glass, preparation method and application thereof 东莞市贝特利新材料有限公司 2020-04-03 CN claimed
CN-110591557-A Organic silicon coating adhesive and preparation method thereof 杭州之江新材料有限公司 2019-12-20 CN claimed
CN-105585945-B A kind of white polyurea waterproof coating material and application 北京东方雨虹防水技术股份有限公司 2018-07-27 CN claimed