SCHEMBL21797166

SCHEMBL21797166

COC(OC)c1ccnc(NCc2ccccc2)n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.46
MAPK8 P45983 1/20 0.46
CYP1A2 P05177 2/20 0.44
CYP2C19 P33261 2/20 0.44
LCK P06239 1/20 0.44
USP2 O75604 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
HTT P42858 1/20 0.43
NOS2 P35228 1/20 0.43
RAB9A P51151 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
MKNK1 Q9BUB5 1/20 0.42
MAPT P10636 2/20 0.42

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
SCHEMBL21797185 0.79 KMT2A (0.43) CDC7MAPK8CYP1A2CYP2C19RAB9A
SCHEMBL4490400 0.79 AURKA (0.54) MAPK8RAB9AKMT2AMEN1NPC1
SCHEMBL2036780 0.78 POLB (0.50) CYP1A2CYP2C19CYP3A4CYP2D6TSHR
SCHEMBL16815715 0.78 MKNK1 (0.47) CYP1A2CYP2C19CYP3A4CLK4RAB9A
SCHEMBL5622348 0.77 HTT (0.61) CDC7MAPK8CYP1A2CYP2C19LCK
SCHEMBL1800915 0.76 SMN1; SMN2 (0.43) RAB9AL3MBTL1KMT2AMEN1NPC1
SCHEMBL16815942 0.76 L3MBTL1 (0.45) RAB9ANPSR1L3MBTL1KMT2AMEN1
SCHEMBL27862873 0.75 CA1 (0.51) CDC7MAPK8RAB9ANPSR1KMT2A
SCHEMBL12597156 0.74 NPSR1 (0.55) CDC7MAPK8CYP1A2CYP2C19LCK
SCHEMBL12411162 0.73 MAPK8 (0.47) MAPK8CYP1A2LCKRAB9AL3MBTL1

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114794106-A Compound type photocatalytic quaternary ammonium salt disinfectant capable of continuously killing microorganisms and viruses 北京绿羽天城环保科技有限公司 2022-07-29 CN claimed
CN-112106788-A Low-odor low-corrosivity neutral disinfectant and preparation method thereof 湖北一末环保实业有限公司 2020-12-22 CN claimed
EP-3619204-B1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES TIANLI BIOTECH PTY LTD (AU) 2025-10-01 EP disclosed
CN-111848834-B Application of cationic polymer modified by fluorine-containing compound in preparing medicine for transmucosal administration 苏州大学 2023-01-24 CN disclosed
US-20220380343-A1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES TIANLI BIOTECH PTY LTD (AU) 2022-12-01 US disclosed
CN-114794106-A Compound type photocatalytic quaternary ammonium salt disinfectant capable of continuously killing microorganisms and viruses 北京绿羽天城环保科技有限公司 2022-07-29 CN disclosed
CN-109322167-B Special film material for tent 宁波天盾防水材料有限公司 2021-09-14 CN disclosed
CN-112106788-A Low-odor low-corrosivity neutral disinfectant and preparation method thereof 湖北一末环保实业有限公司 2020-12-22 CN disclosed
CN-111848834-A Application of cationic polymer modified by fluorine-containing compound in preparing transmucosal drug delivery of drug 苏州大学 2020-10-30 CN disclosed
CN-111848832-A Application of fluorine-containing compound modified cationic polymer as drug carrier and preparation method thereof 苏州大学 2020-10-30 CN disclosed
CN-111789798-A Bactericide containing aloe extract and preparation method thereof 珠海中科先进技术研究院有限公司 2020-10-20 CN disclosed
US-20200079757-A1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES THE UNIVERSITY OF MELBOURNE (AU) 2020-03-12 US disclosed
CN-110753688-A Compounds for the treatment of respiratory diseases 墨尔本大学 2020-02-04 CN 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-20220380343-A1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES LTC4S, LTB4R2, LTB4R CDC7 4010/4885MAPK8 4214/4885CYP1A2 568/4885
US-20200079757-A1 COMPOUNDS FOR THE TREATMENT OF RESPIRATORY DISEASES LTC4S, LTB4R2, LTB4R CDC7 4010/4885MAPK8 4214/4885CYP1A2 568/4885

“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.