SCHEMBL920242

SCHEMBL920242

COc1ccccc1COc1c[c]ccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.49
ABCB1 P08183 3/20 0.48
PARP14 Q460N5 1/20 0.44
PARP10 Q53GL7 1/20 0.44
HTR1A P08908 1/20 0.43
ADRA1D P25100 1/20 0.43
ADRA1A P35348 1/20 0.43
ADRA1B P35368 1/20 0.43
TAAR1 Q96RJ0 1/20 0.41
BCHE P06276 2/20 0.40
SGMS2 Q8NHU3 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ALKBH1 Q13686 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 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
SCHEMBL9036901 0.84 IDO1 (0.53) IDO1ABCB1ADRA1ATAAR1SGMS2
SCHEMBL920917 0.82 IDO1 (0.53) IDO1ABCB1PARP14PARP10HTR1A
SCHEMBL4779293 0.81 ABCB1 (0.62) IDO1ABCB1PARP14PARP10HTR1A
SCHEMBL919794 0.81 MAOB (0.49) SGMS2KMT2A
SCHEMBL6635548 0.79 SCN8A (0.53) BCHECHRM2CHRM1MEN1KMT2A
SCHEMBL919574 0.78 NR4A2 (0.49) IDO1MEN1KMT2AGAAMAPT
SCHEMBL920290 0.78 MAOB (0.51) IDO1PARP14PARP10
SCHEMBL4638439 0.76 CYP2C9 (0.41) IDO1L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL23116 0.76 ABCB1 (0.55) IDO1ABCB1PARP14PARP10HTR1A
SCHEMBL5227019 0.75 FFAR1 (0.40) KMT2A

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
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 IDO1 675/4885ABCB1 2966/4885PARP14 4793/4885
US-20110201649-A1 AGRICULTURAL COMPOSITION H1-0, H1-3, H1-2 IDO1 236/4885ABCB1 4095/4885PARP14 4758/4885

“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.