SCHEMBL21998934

SCHEMBL21998934

CCCCCCCCC(=O)NCc1ccc(CCC(=O)O)cc1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.73
FAAH O00519 2/20 0.63
TRPV1 Q8NER1 2/20 0.62
HPGD P15428 2/20 0.60
CNR1 P21554 2/20 0.60
CNR2 P34972 1/20 0.60
ALDH1A1 P00352 1/20 0.60
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
STS P08842 1/20 0.59
S1PR1 P21453 2/20 0.58
S1PR3 Q99500 2/20 0.58
S1PR2 O95136 1/20 0.58

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
SCHEMBL3809498 0.89 EPHX2 (0.84) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL4970472 0.85 EPHX2 (0.61) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL29052372 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL5696750 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL5471650 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
Nonanoic Acid Benzylamide SCHEMBL3280214 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
N-Benzyldodecanamide SCHEMBL3977374 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL16714726 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL2524088 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1
SCHEMBL2166861 0.84 EPHX2 (1.00) EPHX2FAAHTRPV1HPGDCNR1

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-20200148937-A1 INHIBITING HYDROCARBON HYDRATE AGGLOMERATION COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2020-05-14 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-20200148937-A1 INHIBITING HYDROCARBON HYDRATE AGGLOMERATION H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, AHR, SHH EPHX2 2131/4885FAAH 376/4885TRPV1 368/4885

“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.