SCHEMBL2752018

SCHEMBL2752018

c1ccc(Cc2cccs2)nc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.46
ESR1 P03372 1/20 0.46
POLB P06746 1/20 0.46
STAT3 P40763 1/20 0.46
ESR2 Q92731 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.44
HRH1 P35367 2/20 0.44
CYP2D6 P10635 2/20 0.44
CYP1A2 P05177 1/20 0.44
CHRM2 P08172 1/20 0.44
CHRM5 P08912 1/20 0.44
ADRA2A P08913 1/20 0.44
CHRM1 P11229 1/20 0.44
CYP2C9 P11712 1/20 0.44
ADRA2B P18089 1/20 0.44
NFKB1 P19838 1/20 0.44
DRD1 P21728 1/20 0.44
SLC6A2 P23975 1/20 0.44
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44

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
SCHEMBL2883476 0.83 HRH1 (0.50) SMN1; SMN2ESR1POLBSTAT3ESR2
SCHEMBL2886310 0.80 HRH1 (0.54) SMN1; SMN2ESR1POLBSTAT3ESR2
SCHEMBL17997542 0.79 CHRM2 (0.51) SMN1; SMN2ESR1POLBSTAT3ESR2
SCHEMBL11337822 0.78 ADRA1D (0.47) POLBL3MBTL1HRH1CYP2D6CYP1A2
SCHEMBL14366318 0.78 TSHR (0.46) SMN1; SMN2ESR1POLBSTAT3ESR2
SCHEMBL21241290 0.77 ADRA1D (0.39) SMN1; SMN2ESR1POLBSTAT3ESR2
SCHEMBL13610468 0.76 SMN1; SMN2 (0.47) SMN1; SMN2ESR1POLBSTAT3ESR2
SCHEMBL41191 0.76 L3MBTL1 (0.59) SMN1; SMN2L3MBTL1HRH1HRH3LMNA
SCHEMBL29830938 0.76 L3MBTL1 (0.59) SMN1; SMN2L3MBTL1HRH1HRH3LMNA
SCHEMBL10565206 0.75 NPC1 (0.41) SMN1; SMN2L3MBTL1CYP2D6CYP1A2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106674190-B A kind of synthetic method of 2-thenylaminine 台州市创源工业技术有限公司 2019-05-10 CN claimed
CN-106800519-B Ultrasonic radiation method rapid synthesis bridging type pair, the universal method and application of three, four amide derivatives 中南民族大学 2019-03-12 CN claimed
CN-109232593-A A kind of fluorescence probe and preparation method thereof detecting ferric ion 华南理工大学 2019-01-18 CN claimed
CN-108997546-A A kind of carbon containing nitrogen and the benzoxazine resin of azo structure and preparation method thereof 西南石油大学 2018-12-14 CN claimed
CN-108997548-A A kind of photolytic activity benzoxazine resin and preparation method thereof 西南石油大学 2018-12-14 CN claimed
CN-106084286-B A kind of halogen-free expansion type flame-proof carbon forming agent compound and preparation method thereof 浙江旭森非卤消烟阻燃剂有限公司 2018-10-30 CN claimed
CN-108461632-A Perovskite composite structure 华邦电子股份有限公司 2018-08-28 CN claimed
CN-107523015-A CNT montmorillonite self-assembled nanometer powder is grafted the preparation method of galss fiber reinforced resin composite 河海大学 2017-12-29 CN claimed
CN-107445142-A A kind of preparation method of CNT montmorillonite self-assembled nanometer powder 河海大学 2017-12-08 CN claimed
CN-107338236-A The functional material for being used to fix Azodrin degradation bacteria being modified based on acrylic resin 光合强化(北京)生物科技有限公司 2017-11-10 CN claimed
CN-104620104-B Affinity Reagents for Protein Purification 非凡食品有限公司 2017-03-01 CN claimed
CN-106349147-A Synthetic method of pyrrole derivatives 南阳师范学院 2017-01-25 CN claimed
CN-105968351-A Sulfur-containing macromolecule triazine polymer and preparation method thereof 浙江旭森非卤消烟阻燃剂有限公司 2016-09-28 CN claimed
CN-105885045-A Organic selenium triazine polymer and preparation method thereof 浙江旭森非卤消烟阻燃剂有限公司 2016-08-24 CN claimed
CN-105585583-A Non-peptide IAP (inhibitor of apoptosis protein) antagonist as well as synthetic method and application thereof UNIV GUANGDONG TECHNOLOGY 2016-05-18 CN claimed
CN-105566447-A Peptoid antagonist of anti-apoptosis protein and synthesis method and application of peptoid antagonist UNIV GUANGDONG TECHNOLOGY 2016-05-11 CN claimed
CN-105237466-A Method for compounding tri-substituted pyridine derivatives UNIV NANYANG NORMAL 2016-01-13 CN claimed
CN-102875564-B The nitrogen of tool anti-tumor activity replaces podophyllum derivative and its production and use Hubei Industry University (CN) 2015-10-21 CN claimed
CN-102875564-A Nitrogen substitution podophyllum type derivatives with antitumor activity and preparation method and application thereof UNIV HUBEI TECHNOLOGY 2013-01-16 CN claimed
EP-0745080-B1 NOVEL MERCAPTOACETYLAMIDE DISULFIDE DERIVATIVES USEFUL AS INHIBITORS OF ENKEPHALINASE AND ACE MERRELL PHARMA INC (US) 1999-03-03 EP claimed