SCHEMBL20205684

SCHEMBL20205684

CCCCCCCCCC(C)/C=C(/C(=O)CC)C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 3/20 0.43
ZDHHC7 Q9NXF8 1/20 0.41
CA1 P00915 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
GLO1 Q04760 1/20 0.38
ABCB1 P08183 1/20 0.36
CA2 P00918 1/20 0.36
ACE2 Q9BYF1 1/20 0.35
BIRC2 Q13490 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
CYP3A4 P08684 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GPR84 Q9NQS5 2/20 0.34
NAAA Q02083 1/20 0.34

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
SCHEMBL12693570 0.91 ZDHHC7 (0.45) FAAHZDHHC7CA1NPSR1GLO1
SCHEMBL3915573 0.87 GLO1 (0.50) FAAHZDHHC7CA1NPSR1GLO1
SCHEMBL20205672 0.87 GLO1 (0.50) FAAHZDHHC7CA1NPSR1GLO1
SCHEMBL3915569 0.87 GLO1 (0.50) FAAHZDHHC7CA1NPSR1GLO1
SCHEMBL20205355 0.76 ZDHHC7 (0.50) FAAHZDHHC7CA1ABCB1CA2
SCHEMBL20205749 0.75 CYP2C9 (0.48) FAAHZDHHC7NPSR1KDM4EALDH1A1
SCHEMBL4011240 0.74 TSHR (0.34) CA1NPSR1CA2ALDH1A1LMNA
SCHEMBL28579233 0.74 EP300 (0.50) ZDHHC7CA1ACE2LMNAMAPT
SCHEMBL10741995 0.73 GLO1 (0.56) NPSR1GLO1KDM4EALDH1A1LMNA
SCHEMBL15913764 0.73 NPSR1 (0.43) FAAHZDHHC7CA1NPSR1GLO1

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-20190276387-A1 PRECURSOR COMPOUNDS FOR FRAGRANT ALDEHYDES GIVAUDAN SA (CH) 2019-09-12 US disclosed
WO-2018096176-A1 PRECURSOR COMPOUNDS FOR FRAGRANT ALDEHYDES GIVAUDAN SA (CH) 2018-05-31 WO 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-20190276387-A1 PRECURSOR COMPOUNDS FOR FRAGRANT ALDEHYDES HAAO, B3GNT2, NAA40 FAAH 77/4885ZDHHC7 251/4885CA1 1292/4885

“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.