SCHEMBL5029203

SCHEMBL5029203

CC(O)CNC(=O)CCCCCCC/C=C/CCCCCCCC(=O)NCC(C)O

nearest known ligand 0.72

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.50
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
FAAH O00519 3/20 0.49
CNR1 P21554 2/20 0.49
ALDH1A1 P00352 2/20 0.49
HPGD P15428 2/20 0.49
SLC6A5 Q9Y345 2/20 0.49
TRPV1 Q8NER1 1/20 0.49
MAPT P10636 1/20 0.49
ALOX12 P18054 1/20 0.49
BLM P54132 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ASAH2 Q9NR71 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
SCHEMBL4096417 0.94 EPHX2 (0.60) EPHX2MEN1KMT2AFAAHCNR1
SCHEMBL2701073 0.94 EPHX2 (0.60) EPHX2MEN1KMT2AFAAHCNR1
SCHEMBL2701074 0.94 EPHX2 (0.60) EPHX2MEN1KMT2AFAAHCNR1
SCHEMBL4886542 0.94 EPHX2 (0.60) EPHX2MEN1KMT2AFAAHCNR1
SCHEMBL4320018 0.94 EPHX2 (0.60) EPHX2MEN1KMT2AFAAHCNR1
SCHEMBL5028879 0.94 EPHX2 (0.52) EPHX2MEN1KMT2AFAAHCNR1
SCHEMBL2952168 0.89 MEN1 (0.68) MEN1KMT2ACNR1ALDH1A1HPGD
SCHEMBL14984044 0.89 FAAH (0.48) EPHX2MEN1KMT2AFAAHALDH1A1
SCHEMBL6940505 0.87 ALDH1A1 (0.50) EPHX2MEN1KMT2AFAAHALDH1A1
SCHEMBL23521334 0.86 ALDH1A1 (0.54) MEN1KMT2AFAAHALDH1A1TRPV1

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-10322994-B2 Fatty amides and derivatives from natural oil metathesis STEPAN COMPANY (US) 2019-06-18 US disclosed
US-20170158617-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS STEPAN CO (US) 2017-06-08 US disclosed
US-9573884-B2 Imidazoline amides and derivitives from natural oil metathesis STEPAN COMPANY (US) 2017-02-21 US disclosed
EP-2632256-B1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS STEPAN CO (US) 2017-02-01 EP disclosed
US-20150376118-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS STEPAN CO (US) 2015-12-31 US disclosed
US-9175245-B2 Fatty amides and derivatives from natural oil metathesis STEPAN COMPANY (US) 2015-11-03 US disclosed
US-20130225470-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS STEPAN COMPANY (US) 2013-08-29 US disclosed
WO-2012061094-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS STEPAN COMPANY (US) 2012-05-10 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 (4 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-20130225470-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS SGMS1, DEGS1, DGAT2 EPHX2 1002/4885MEN1 1517/4885KMT2A 1148/4885
US-20170158617-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS DEGS1, SGMS1, DGAT2 EPHX2 878/4885MEN1 1612/4885KMT2A 1128/4885
US-20150376118-A1 FATTY AMIDES AND DERIVATIVES FROM NATURAL OIL METATHESIS DEGS1, SGMS1, DGAT2 EPHX2 878/4885MEN1 1612/4885KMT2A 1128/4885
US-10322994-B2 Fatty amides and derivatives from natural oil metathesis DEGS1, SGMS1, DGAT2 EPHX2 878/4885MEN1 1612/4885KMT2A 1128/4885

“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.