SCHEMBL629988

SCHEMBL629988

c1ccc(Cc2ncc3[nH]cnc3n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.52
PDE4B Q07343 1/20 0.52
PDE4C Q08493 1/20 0.52
PDE4D Q08499 1/20 0.52
CDK2 P24941 2/20 0.51
ALDH1A1 P00352 1/20 0.46
KDM4E B2RXH2 1/20 0.46
TAAR1 Q96RJ0 3/20 0.45
HRH3 Q9Y5N1 1/20 0.45
CHRM4 P08173 1/20 0.44
CHRM5 P08912 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
HTR3A P46098 1/20 0.44
HTR6 P50406 1/20 0.44
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
POLA1 P09884 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
SCHEMBL8332578 0.86 CDK2 (0.50) PDE4APDE4BPDE4CPDE4DCDK2
SCHEMBL5493577 0.79 ALDH1A1 (0.49) PDE4APDE4BPDE4CPDE4DCDK2
SCHEMBL5440118 0.78 CDK2 (0.49) PDE4APDE4BPDE4CPDE4DCDK2
SCHEMBL10602621 0.78 CDK2 (0.49) PDE4APDE4BPDE4CPDE4DCDK2
SCHEMBL9080043 0.77 CYP1A2 (0.50) CDK2CYP1A2
SCHEMBL28076050 0.76 CHRM4 (0.43) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL27886361 0.76 GAA (0.53) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL30327261 0.75 HTR2C (0.43) PDE4APDE4BPDE4CPDE4DTAAR1
SCHEMBL4329849 0.75 HTR2C (0.43) PDE4APDE4BPDE4CPDE4DALDH1A1
SCHEMBL1262849 0.75 AOC3 (0.47) PDE4APDE4BPDE4CPDE4DALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118805676-A Rapid training method for bird's nest fruits 海南希源生态农业股份有限公司 2024-10-22 CN claimed
CN-117099578-A Nutritional propagation method of onion male sterile plant 兰州龙腾农业科技有限公司 2023-11-24 CN claimed
CN-114262335-A Lysosome-targeted super-resolution self-flashing dye and synthesis method and biological application thereof 中国科学院大连化学物理研究所 2022-04-01 CN claimed
CN-114262334-A Super-resolution imaging self-flashing fluorescent dye for monitoring dynamic lysosome in real time under nanometer resolution, and synthetic method and application thereof 中国科学院大连化学物理研究所 2022-04-01 CN claimed
CN-114262333-A Near-infrared fluorescent dye for lysosome super-resolution imaging and preparation method and application thereof 中国科学院大连化学物理研究所 2022-04-01 CN claimed
CN-114262609-A Self-flashing fluorescent dye for long-time super-resolution fluorescence imaging of lysosome and synthetic method and application thereof 中国科学院大连化学物理研究所 2022-04-01 CN claimed
CN-113998653-A Culture medium subpackaging device and preparation method thereof 广西壮族自治区农业科学院 2022-02-01 CN claimed
CN-112913690-A Peony in-vitro regeneration method 四川农业大学 2021-06-08 CN claimed
CN-109197582-A A kind of culture medium of golden flower tea callus bud induction 罗甸县五湖生态农业旅游开发有限责任公司 2019-01-15 CN claimed
CN-108935094-A A kind of bletilla striata cultural method rapidly and efficiently 贵州发来地农业科技有限公司 2018-12-07 CN claimed
CN-103125397-A Culture medium for generating and growing medicinal woody plant callus and application thereof NANJING SIMONI BIOLOG TECHNOLOGY CO LTD 2013-06-05 CN claimed
CN-102267935-A Indoquinone derivatives, and preparation method and application thereof 2011-12-07 CN claimed
CN-101433183-A Method for cultivating regenerated plant from isolated microspore of brassica XIANGJUN LIU (CN) 2009-05-20 CN claimed
CN-100486941-C Whole-nutrition biological flushing and spreading fertilizer and preparation method thereof INST OF SOIL AND FERTILIZER SH (CN) 2009-05-13 CN claimed
CN-101258834-A Method for breeding high content stevioside genetic material UNIV GUILIN TECH GUT (CN) 2008-09-10 CN claimed
CN-1552198-A Method for culturing cauliflower regenerative tree by free microspore culture technology 天津科润农业科技股份有限公司 2004-12-08 CN claimed
CN-1502225-A Method for culturing tissue of forest plant for efficient inducing tufted lateral bud growth 吉林省东北师大林木生物工程有限责任 2004-06-09 CN claimed
CN-1453251-A Acid liquid fertilizer for drip irrigation and its prepn INST PROCESS ENG CAS (CN) 2003-11-05 CN claimed
CN-1085042-A Biocide for protecting cotton bolls and eliminating fusarium wilt of cotton WANG LIANFANG (CN) 1994-04-13 CN claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed