SCHEMBL3758606

SCHEMBL3758606

CC#CCOc1cccc(CN)c1F

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RPS6KA1 Q15418 1/20 0.36
MAOB P27338 3/20 0.33
HTR1A P08908 1/20 0.33
TAAR1 Q96RJ0 1/20 0.32
PNMT P11086 1/20 0.32
PDE4B Q07343 1/20 0.31
SLC1A5 Q15758 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP12 P39900 1/20 0.31
RAB9A P51151 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGS2 P35354 1/20 0.31
ADAM17 P78536 1/20 0.31
LOXL2 Q9Y4K0 1/20 0.31

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
SCHEMBL3770661 0.86 RPS6KA1 (0.36) RPS6KA1MAOBTAAR1PNMTRAB9A
SCHEMBL3771148 0.84 RPS6KA1 (0.35) RPS6KA1MAOBTAAR1PNMTL3MBTL1
SCHEMBL3764757 0.83 PTGS2 (0.35) RPS6KA1MAOBRAB9AL3MBTL1PTGS2
SCHEMBL3758658 0.83 RPS6KA1 (0.34) RPS6KA1MAOBL3MBTL1
SCHEMBL3770664 0.82 L3MBTL1 (0.36) RPS6KA1MAOBRAB9AL3MBTL1
SCHEMBL3769110 0.81 L3MBTL1 (0.35) RPS6KA1L3MBTL1
SCHEMBL3770814 0.81 PTGS2 (0.37) RPS6KA1RAB9AL3MBTL1PTGS2
SCHEMBL3766553 0.80 MAPT (0.46) RPS6KA1MAOBPNMTLOXL2
SCHEMBL3761760 0.80 PTGS2 (0.38) RPS6KA1PTGS2
SCHEMBL3662868 0.76 APP (0.35) HTR1APDE4BMMP1MMP2MMP9

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 RPS6KA1 1556/4885MAOB 667/4885HTR1A 2686/4885

“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.