SCHEMBL422808

SCHEMBL422808

CCCCCCCCCCCCCCCCC(C)CCCCCCCC(C)C(C)=O

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.66
CA1 P00915 2/20 0.55
FAAH O00519 1/20 0.46
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 1/20 0.46
GPR84 Q9NQS5 4/20 0.45
FDPS P14324 3/20 0.45
SPHK1 Q9NYA1 1/20 0.45
MAPT P10636 1/20 0.44
BLM P54132 1/20 0.44
LCK P06239 1/20 0.44
PPARD Q03181 1/20 0.44
ZDHHC20 Q5W0Z9 1/20 0.44
ZDHHC2 Q9UIJ5 1/20 0.44

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
SCHEMBL591815 1.00 ACE2 (0.66) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL13819798 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL7912103 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL11386622 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL13819794 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL2573740 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL13819793 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL13538692 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL574092 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4
SCHEMBL8513608 0.94 CA1 (0.61) ACE2CA1FAAHFFAR1FFAR4

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-20120017491-A1 Gel bait for controlling crawling harmful insects BAYER CROPSCIENCE AG (DE) 2012-01-26 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-20120017491-A1 Gel bait for controlling crawling harmful insects RAC3, RAC1, RAC2 ACE2 4033/4885CA1 4299/4885FAAH 1348/4885

“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.