SCHEMBL919962

SCHEMBL919962

Fc1[c]ccc(NCc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
PTPN1 P18031 2/20 0.44
PTPN11 Q06124 1/20 0.44
MAOA P21397 1/20 0.43
PTPRZ1 P23471 1/20 0.41
LMNA P02545 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HTR2C P28335 1/20 0.40
DHFR P00374 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KCNH3 Q9ULD8 1/20 0.40
METAP2 P50579 1/20 0.39
CA12 O43570 1/20 0.39
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA9 Q16790 1/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 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
SCHEMBL6306011 0.79 HTT (0.44) HTTPTPN1PTPN11MAOAL3MBTL1
SCHEMBL11728559 0.79 HTT (0.44) HTTPTPN1PTPN11MAOAGAA
SCHEMBL27665974 0.76 KDM4E (0.45) HTTPTPN1PTPN11MAOAGAA
SCHEMBL919320 0.74 ALDH1A1 (0.52) HTTLMNAGAAL3MBTL1ALDH1A1
SCHEMBL694416 0.74 HTT (0.59) HTTPTPN1PTPN11PTPRZ1GAA
SCHEMBL6690772 0.73 HTT (0.57) HTTPTPN1PTPN11HTR2CKCNH3
SCHEMBL11015099 0.73 HPGD (0.63) LMNAGAAL3MBTL1SMN1; SMN2METAP2
SCHEMBL1418808 0.73 CYP1A2 (0.34) HTTCYP1A2CYP2D6
SCHEMBL11513455 0.73 MEN1 (0.66) HTTPTPN1PTPN11MAOAPTPRZ1
SCHEMBL20804371 0.72 HTT (0.61) HTTPTPN1PTPN11PTPRZ1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115996929-A Antagonists of adenosine A2a receptors 阿道尔克斯治疗有限公司 2023-04-21 CN claimed
CN-115996929-A Antagonists of adenosine A2a receptors 阿道尔克斯治疗有限公司 2023-04-21 CN disclosed
CN-102757426-A Benzoisooxazolyl substituted thiazole compound, preparation method and application thereof INST MEDICINAL BIOTECHNOLOGY 2012-10-31 CN disclosed
US-20110201649-A1 AGRICULTURAL COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-18 US disclosed
EP-2345328-A1 COMPOSITION FOR AGRICULTURAL USE Sumitomo Chemical Company, Limited (JP) 2011-07-20 EP disclosed
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-13 US disclosed
EP-2248423-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS Sumitomo Chemical Company, Limited (JP) 2010-11-10 EP 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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 HTT 2561/4885PTPN1 197/4885PTPN11 216/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 HTT 450/4885PTPN1 3115/4885PTPN11 2810/4885

“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.