SCHEMBL920231

SCHEMBL920231

CCCCc1ccccc1Oc1ccc(CNC(=O)c2ccc(C)nc2N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
HPGD P15428 4/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
GAA P10253 2/20 0.45
HTT P42858 2/20 0.45
ATM Q13315 1/20 0.45
MAPK14 Q16539 2/20 0.42
MAPK8 P45983 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
AGTR1 P30556 1/20 0.40
AGTR2 P50052 1/20 0.40
CARM1 Q86X55 2/20 0.40
PRMT6 Q96LA8 2/20 0.40
CA2 P00918 1/20 0.40
CA4 P22748 1/20 0.40
PTGER4 P35408 1/20 0.40
PTGER2 P43116 1/20 0.40
ADORA2A P29274 2/20 0.39
ADORA1 P30542 1/20 0.39
KDM4E B2RXH2 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
SCHEMBL919878 0.97 ALDH1A1 (0.44) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL921228 0.94 ALDH1A1 (0.47) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL920517 0.91 ALDH1A1 (0.47) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL920777 0.90 ALDH1A1 (0.44) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL921086 0.89 ALDH1A1 (0.47) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL922806 0.88 CARM1 (0.43) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL919238 0.87 ALDH1A1 (0.42) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL920682 0.87 ADORA2A (0.44) ALDH1A1HPGDGAAHTTMAPK14
SCHEMBL921292 0.87 ALDH1A1 (0.44) ALDH1A1HPGDL3MBTL1GAAHTT
SCHEMBL27803810 0.87 MEN1 (0.46) ALDH1A1L3MBTL1GAAHTT

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 3 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
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 (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-20110009454-A1 COMPOSITION FOR AGRICULTURAL USE FOR CONTROLLING OR PREVENTING PLANT DISEASES CAUSED BY PLANT PATHOGENS WIZ, TST, NAT1 ALDH1A1 2743/4885HPGD 1273/4885L3MBTL1 1292/4885

“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.