SCHEMBL921790

SCHEMBL921790

C#CCCCOc1cccc(CNC(=O)OC(C)(C)C)c1F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA1 Q15418 1/20 0.48
SCN9A Q15858 1/20 0.40
KCNA5 P22460 1/20 0.38
KCNQ4 P56696 1/20 0.36
KCNQ5 Q9NR82 1/20 0.36
KDM4A O75164 1/20 0.36
NQO2 P16083 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
CA12 O43570 4/20 0.35
CA1 P00915 4/20 0.35
CA2 P00918 4/20 0.35
CA9 Q16790 4/20 0.35
ADRB2 P07550 1/20 0.35
HTR1A P08908 1/20 0.35
POLB P06746 2/20 0.34
LMNA P02545 1/20 0.34
EPHX2 P34913 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34

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
SCHEMBL3659959 0.84 KDM4E (0.37) RPS6KA1ADRB2KDM4EALDH1A1MEN1
SCHEMBL13687788 0.83 RPS6KA1 (0.53) RPS6KA1SCN9AKCNA5KDM4ANQO2
SCHEMBL17785276 0.80 RPS6KA1 (0.55) RPS6KA1KCNA5KDM4AALDH1A1MEN1
SCHEMBL3660767 0.79 KDM4E (0.34) SCN9AKCNQ4KCNQ5KDM4EALDH1A1
SCHEMBL16397127 0.76 RPS6KA1 (0.48) RPS6KA1KCNA5KDM4ANQO2POLB
SCHEMBL920215 0.75 MAPK8 (0.46) LMNAKDM4EALDH1A1MEN1KMT2A
SCHEMBL30133675 0.75 RPS6KA1 (0.49) RPS6KA1SCN9AKCNA5POLBKDM4E
SCHEMBL23616924 0.75 RPS6KA1 (0.52) RPS6KA1KCNA5KDM4ANQO2CTSS
SCHEMBL16415869 0.75 RPS6KA1 (0.49) RPS6KA1KCNA5KDM4ANQO2CTSS
SCHEMBL17785321 0.75 RPS6KA1 (0.48) RPS6KA1KCNA5CTSSCTSKKDM4E

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-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
US-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHIEMCAL COMPANY LIMITED (JP) 2010-12-09 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 RPS6KA1 3355/4885SCN9A 1203/4885KCNA5 1544/4885
US-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME ATL3, NAT1, C5 RPS6KA1 1556/4885SCN9A 2088/4885KCNA5 1980/4885

“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.