SCHEMBL20205355

SCHEMBL20205355

CCCCCCCCCC(C)C=C(C(=O)OC)C(=O)OC

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.50
ABCB1 P08183 1/20 0.43
CA1 P00915 2/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
CA2 P00918 1/20 0.41
FAAH O00519 4/20 0.40
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40
ACE2 Q9BYF1 1/20 0.40
LMNA P02545 2/20 0.39
USP2 O75604 1/20 0.39
GPR84 Q9NQS5 3/20 0.39
FFAR1 O14842 1/20 0.39
BIRC2 Q13490 3/20 0.38

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
SCHEMBL21049824 0.85 ZDHHC7 (0.53) ZDHHC7ABCB1CA1ADH1BADH1C
SCHEMBL12693570 0.85 ZDHHC7 (0.45) ZDHHC7ABCB1CA1FAAHACE2
SCHEMBL15913628 0.81 ZDHHC7 (0.43) ZDHHC7ABCB1CA1ADH1BADH1C
SCHEMBL28579233 0.80 EP300 (0.50) ZDHHC7CA1ACE2LMNAGPR84
SCHEMBL20205672 0.78 GLO1 (0.50) ZDHHC7ABCB1CA1FAAHACE2
SCHEMBL3915573 0.78 GLO1 (0.50) ZDHHC7ABCB1CA1FAAHACE2
SCHEMBL3915569 0.78 GLO1 (0.50) ZDHHC7ABCB1CA1FAAHACE2
SCHEMBL20205354 0.78 LMNA (0.44) ZDHHC7ABCB1CA1FAAHCNR1
SCHEMBL15913978 0.77 MEN1 (0.35) CA1CA2
SCHEMBL4011240 0.77 TSHR (0.34) CA1CA2LMNA

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 ZDHHC7 251/4885ABCB1 4643/4885CA1 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.