SCHEMBL3764757

SCHEMBL3764757

CCCC#CCOc1cccc(CN)c1F

nearest known ligand 0.38

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.35
RPS6KA1 Q15418 1/20 0.34
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAOB P27338 2/20 0.31
HCAR2 Q8TDS4 1/20 0.30

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
SCHEMBL3770814 0.92 PTGS2 (0.37) PTGS2RPS6KA1RAB9AL3MBTL1
SCHEMBL3761760 0.90 PTGS2 (0.38) PTGS2RPS6KA1
SCHEMBL3764651 0.88 CYP1A2 (0.35) PTGS2RPS6KA1L3MBTL1MAOB
SCHEMBL3770661 0.88 RPS6KA1 (0.36) PTGS2RPS6KA1RAB9AL3MBTL1MAOB
SCHEMBL3772924 0.87 CYP1A2 (0.37) RPS6KA1L3MBTL1
SCHEMBL3758606 0.83 RPS6KA1 (0.36) PTGS2RPS6KA1RAB9AL3MBTL1MAOB
SCHEMBL3764290 0.80 CYP1A2 (0.40) PTGS2RPS6KA1L3MBTL1
SCHEMBL3764404 0.79 RPS6KA1 (0.34) RPS6KA1L3MBTL1MAOB
SCHEMBL3656907 0.78 PTGS2 (0.34) PTGS2RAB9AL3MBTL1
SCHEMBL3771871 0.78 L3MBTL1 (0.36) RPS6KA1L3MBTL1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME SUMITOMO CHIEMCAL COMPANY LIMITED (JP) 2010-12-09 US 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-20100311790-A1 AMIDE COMPOUNDS AND PLANT DISEASE CONTROLLING METHOD USING SAME ATL3, NAT1, C5 PTGS2 3626/4885RPS6KA1 1556/4885RAB9A 95/4885

“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.