SCHEMBL920869

SCHEMBL920869

N#Cc1cccc(Oc2ccccc2Cl)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.54
EPAS1 Q99814 5/20 0.48
CYP19A1 P11511 1/20 0.46
EGFR P00533 1/20 0.46
ERBB2 P04626 1/20 0.46
ERBB3 P21860 1/20 0.46
ERBB4 Q15303 1/20 0.46
VEGFA P15692 1/20 0.43
LMNA P02545 1/20 0.43
ADRB2 P07550 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
DPP4 P27487 1/20 0.42
HTR2A P28223 2/20 0.42
KCNH2 Q12809 2/20 0.42
SLC6A4 P31645 1/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41

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
SCHEMBL8432193 0.88 AR (0.55) AREPAS1CYP19A1VEGFASLC6A4
SCHEMBL3258951 0.81 EGFR (0.47) AREPAS1CYP19A1EGFRERBB2
SCHEMBL2747584 0.81 EGFR (0.50) AREPAS1CYP19A1EGFRERBB2
SCHEMBL8550179 0.81 AR (0.60) AREPAS1CYP19A1EGFRERBB2
SCHEMBL8432101 0.81 AR (0.49) AREPAS1CYP19A1VEGFASMN1; SMN2
SCHEMBL5897452 0.81 SLC6A4 (0.54) ARCYP19A1LMNAADRB2SMN1; SMN2
SCHEMBL922843 0.80 AR (0.59) AREPAS1VEGFASMN1; SMN2PDE4A
SCHEMBL16670393 0.80 AR (0.54) AREPAS1CYP19A1VEGFAPDE4A
SCHEMBL890666 0.80 GAA (0.58) AREPAS1CYP19A1VEGFAPDE4A
SCHEMBL922800 0.80 EPAS1 (0.47) AREPAS1CYP19A1ERBB2VEGFA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101951771-A Composition for agricultural use for controlling or preventing plant diseases caused by plant pathogens SUMITOMO CHEMICAL CO 2011-01-19 CN 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
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
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
WO-2009107764-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS 住友化学株式会社 (JP) 2009-09-03 WO disclosed
US-7041690-B2 Inhibitors of HCV NS5B polymerase PHARMACIA & UPJOHN COMPANY, LLC (US) 2006-05-09 US disclosed
US-20060004063-A1 Inhibitors of HCV NS5B polymerase PHARMACIA & UPJOHN COMPANY, LLC 2006-01-05 US disclosed
EP-1532128-A1 INHIBITORS OF HCV NS5B POLYMERASE Pharmacia & Upjohn Company LLC (US) 2005-05-25 EP disclosed
US-20040142980-A1 Inhibitors of HCV NS5B polymerase PHARMACIA & UPJOHN COMPANY 2004-07-22 US disclosed
WO-2004002977-A1 INHIBITORS OF HCV NS5B POLYMERASE PHARMACIA & UPJOHN COMPANY LLC (US) 2004-01-08 WO 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 (3 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-20040142980-A1 Inhibitors of HCV NS5B polymerase POLRMT, POLR1E, CTDSP1 AR 4284/4885EPAS1 885/4885CYP19A1 2877/4885
US-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 AR 4285/4885EPAS1 2104/4885CYP19A1 4327/4885
US-20060004063-A1 Inhibitors of HCV NS5B polymerase POLRMT, EIF5B, POLI AR 4343/4885EPAS1 1158/4885CYP19A1 3006/4885

“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.