SCHEMBL21602285

SCHEMBL21602285

CCCCCCCC(C)(CCCC)N1CCCCC1=O

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.36
FAAH O00519 1/20 0.34
MGLL Q99685 1/20 0.34
GAA P10253 1/20 0.33
CCR2 P41597 3/20 0.33
CCR1 P32246 1/20 0.33
CCR5 P51681 1/20 0.33
CXCR4 P61073 1/20 0.33
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
ALDH1A1 P00352 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL19478707 0.98 ALOX5 (0.36) ALOX5FAAHMGLLGAACCR2
SCHEMBL19478690 0.95 ALOX5 (0.35) ALOX5FAAHMGLLGAACCR2
SCHEMBL26946645 0.95 ALOX5 (0.40) ALOX5FAAHMGLLGAACCR2
SCHEMBL26946782 0.95 ALOX5 (0.40) ALOX5FAAHMGLLGAACCR2
SCHEMBL19918770 0.94 MITF (0.33) ALOX5GAAL3MBTL1ALDH1A1MEN1
SCHEMBL21922559 0.94 ALOX5 (0.41) ALOX5FAAHMGLLGAACCR2
SCHEMBL18799294 0.94 ALOX5 (0.41) ALOX5FAAHMGLLGAACCR2
SCHEMBL23346883 0.87 FAAH (0.38) ALOX5FAAHMGLLCCR2CCR1
SCHEMBL29300320 0.87 FAAH (0.38) ALOX5FAAHMGLLCCR2CCR1
SCHEMBL19453101 0.86 ALOX5 (0.36) ALOX5FAAHMGLLGAACCR2

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-20190389899-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF ANTENGENE THERAPEUTICS LIMITED (CN) 2019-12-26 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-20190389899-A1 ECTONUCLEOTIDASE INHIBITORS AND METHODS OF USE THEREOF NT5E, ENTPD5, NT5C2 ALOX5 235/4885FAAH 282/4885MGLL 1232/4885

“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.