SCHEMBL4556566

SCHEMBL4556566

CCCCCC(=O)N1c2ccccc2Sc2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.68
BCHE P06276 12/20 0.67
ADRB3 P13945 1/20 0.67
HRH2 P25021 1/20 0.67
ADRA1D P25100 1/20 0.67
HTR2A P28223 1/20 0.67
SLC6A4 P31645 1/20 0.67
SLC6A3 Q01959 1/20 0.67
ACHE P22303 2/20 0.61
GFER P55789 1/20 0.60
NPSR1 Q6W5P4 1/20 0.56
NOX1 Q9Y5S8 1/20 0.56
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
POLB P06746 1/20 0.55
ATM Q13315 1/20 0.55

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
SCHEMBL8970221 0.98 MAPK1 (0.67) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL7982855 0.89 BCHE (0.67) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL8428979 0.83 MAPK1 (0.70) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL627575 0.82 BCHE (0.65) MAPK1BCHEACHENPSR1NOX1
SCHEMBL6313879 0.79 BCHE (0.65) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL20272375 0.79 BCHE (0.71) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL11618894 0.79 BCHE (0.67) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL20272371 0.78 BCHE (0.61) MAPK1BCHEADRB3HRH2ADRA1D
Hydrochloric Acid SCHEMBL5499595 0.78 BCHE (0.66) MAPK1BCHEADRB3HRH2ADRA1D
SCHEMBL11152974 0.76 MAPK1 (0.58) MAPK1BCHEADRB3HRH2ADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1535890-B1 METHOD FOR PRODUCING P-DICHLOROBENZENE KUREHA CORP (JP) 2009-05-27 EP disclosed
US-7211704-B2 Method for producing p-dichlorobenzene KUREHA CORPORATION (JP) 2007-05-01 US disclosed
US-20060106264-A1 Method for producing p-dichlorobenzene KUREHA CHEMICAL INDUSTRY COMPANY LIMITED (JP) 2006-05-18 US disclosed
EP-1535890-A1 METHOD FOR PRODUCING P-DICHLOROBENZENE Kureha Chemical Industry Co., Ltd. (JP) 2005-06-01 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 (1 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-20060106264-A1 Method for producing p-dichlorobenzene DDT, DCAF15, CLTB MAPK1 3617/4885BCHE 1230/4885ADRB3 2249/4885

“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.