SCHEMBL16619880

SCHEMBL16619880

CCCCCCCC/C=C\CCCCCCCC(=O)NCCC(C)C

nearest known ligand 0.84

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.84
LPAR2 Q9HBW0 1/20 0.67
EPHX2 P34913 2/20 0.67
ALDH1A1 P00352 2/20 0.65
HPGD P15428 2/20 0.65
SLC6A5 Q9Y345 2/20 0.65
TRPV1 Q8NER1 1/20 0.65
MEN1 O00255 1/20 0.65
MAPT P10636 1/20 0.65
ALOX12 P18054 1/20 0.65
BLM P54132 1/20 0.65
KMT2A Q03164 1/20 0.65
TDP1 Q9NUW8 1/20 0.65
KDM4E B2RXH2 1/20 0.62
LPAR1 Q92633 1/20 0.62

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
SCHEMBL26044981 1.00 CNR1 (0.84) CNR1LPAR2EPHX2ALDH1A1HPGD
SCHEMBL16619882 1.00 CNR1 (0.84) CNR1LPAR2EPHX2ALDH1A1HPGD
SCHEMBL24474078 0.91 CNR1 (1.00) CNR1ALDH1A1HPGDSLC6A5TRPV1
SCHEMBL10802572 0.91 EPHX2 (0.72) CNR1LPAR2EPHX2ALDH1A1HPGD
SCHEMBL1695972 0.91 CNR1 (0.68) CNR1LPAR2EPHX2MEN1KMT2A
SCHEMBL1456865 0.91 CNR1 (0.68) CNR1LPAR2EPHX2MEN1KMT2A
SCHEMBL1456478 0.91 CNR1 (0.68) CNR1LPAR2EPHX2MEN1KMT2A
SCHEMBL5866922 0.91 CNR1 (0.68) CNR1LPAR2EPHX2MEN1KMT2A
SCHEMBL17125686 0.89 CNR1 (0.69) CNR1LPAR2EPHX2HPGDMEN1
SCHEMBL9099462 0.88 CNR1 (0.67) CNR1LPAR2EPHX2ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160242443-A1 Organic Compounds GIVAUDAN S.A. (CH) 2016-08-25 US claimed
EP-3057448-A1 ORGANIC COMPOUNDS Givaudan S.A. (CH) 2016-08-24 EP claimed
WO-2015050534-A1 ORGANIC COMPOUNDS GIVAUDAN S.A. (CH) 2015-04-09 WO claimed
US-10674755-B2 Organic Compounds GIVAUDAN S.A. (CH) 2020-06-09 US disclosed
EP-3057448-B1 ORGANIC COMPOUNDS HAVING TASTE-MODIFYING PROPERTIES GIVAUDAN SA (CH) 2017-12-06 EP disclosed
US-20160242443-A1 Organic Compounds GIVAUDAN S.A. (CH) 2016-08-25 US disclosed
EP-3057448-A1 ORGANIC COMPOUNDS Givaudan S.A. (CH) 2016-08-24 EP disclosed
WO-2015050534-A1 ORGANIC COMPOUNDS GIVAUDAN S.A. (CH) 2015-04-09 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-10674755-B2 Organic Compounds C9, PRMT5, CBR3 CNR1 1503/4885LPAR2 4347/4885EPHX2 2845/4885

“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.