SCHEMBL3769700

SCHEMBL3769700

CCC=CCCCCOc1cccc(CN)c1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.47
EPHX2 P34913 2/20 0.45
FAAH O00519 1/20 0.45
CNR1 P21554 1/20 0.45
TSHR P16473 1/20 0.43
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAOB P27338 2/20 0.41
DHFR P00374 7/20 0.41
MAPK1 P28482 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GGPS1 O95749 1/20 0.40

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
SCHEMBL3660582 0.96 PPARA (0.45) PPARAEPHX2FAAHCNR1TSHR
SCHEMBL3657459 0.91 MAOB (0.43) PPARAEPHX2FAAHCNR1TSHR
SCHEMBL3770972 0.87 PPARA (0.42) PPARATSHRKDM4EALDH1A1MAOB
SCHEMBL3770838 0.87 PPARA (0.48) PPARATSHRKDM4EALDH1A1MAOB
SCHEMBL3764400 0.86 PPARA (0.44) PPARATSHRKDM4EALDH1A1MAOB
SCHEMBL3764368 0.86 PPARA (0.50) PPARATSHRMAOBDHFRGGPS1
SCHEMBL3770884 0.82 MAOB (0.43) PPARATSHRKDM4EALDH1A1MAOB
SCHEMBL3775414 0.82 MAOB (0.43) PPARATSHRKDM4EALDH1A1MAOB
SCHEMBL3769194 0.82 AOC3 (0.46) MAOB
SCHEMBL3764504 0.82 PPARA (0.55) PPARAEPHX2FAAHTSHRMAOB

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 PPARA 1791/4885EPHX2 2984/4885FAAH 19/4885

“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.