SCHEMBL13819794

SCHEMBL13819794

CCCCCCCCCCCCCCCC(C)C(C)=O

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.61
ACE2 Q9BYF1 1/20 0.55
GPR84 Q9NQS5 5/20 0.50
FDPS P14324 3/20 0.50
FFAR1 O14842 2/20 0.50
FFAR4 Q5NUL3 1/20 0.50
FAAH O00519 1/20 0.50
SPHK1 Q9NYA1 1/20 0.50
MAPT P10636 1/20 0.48
LCK P06239 1/20 0.48
PPARD Q03181 1/20 0.48
ZDHHC20 Q5W0Z9 1/20 0.48
ZDHHC2 Q9UIJ5 1/20 0.48

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
SCHEMBL14384380 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL2573740 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL8513608 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL13819798 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL13538692 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL13819793 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL574092 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL7912103 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL11386622 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1
SCHEMBL12154896 1.00 CA1 (0.61) CA1ACE2GPR84FDPSFFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9433577-B2 Pharmaceutical composition comprising oligopeptides MERCK PATENT GMBH (DE) 2016-09-06 US disclosed
US-20120288539-A1 PHARMACEUTICAL COMPOSITION COMPRISING OLIGOPEPTIDES MERCK PATENT GMBH (DE) 2012-11-15 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-20120288539-A1 PHARMACEUTICAL COMPOSITION COMPRISING OLIGOPEPTIDES VIP, LNPEP, IAPP CA1 2312/4885ACE2 335/4885GPR84 1804/4885

“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.