SCHEMBL20113878

SCHEMBL20113878

CCCCNC(=O)CCCCCO[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.51
DNM1 Q05193 2/20 0.49
CASP2 P42575 1/20 0.49
ACHE P22303 6/20 0.46
NAAA Q02083 1/20 0.46
EPHX2 P34913 2/20 0.44
CNR1 P21554 2/20 0.44
CNR2 P34972 2/20 0.44
TSHR P16473 1/20 0.44

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
SCHEMBL20113585 0.86 FAAH (0.55) FAAHDNM1EPHX2TSHR
SCHEMBL2011680 0.84 FAAH (0.52) FAAHEPHX2TSHR
SCHEMBL18115162 0.83 FAAH (0.44) FAAHACHEEPHX2CNR1CNR2
SCHEMBL20104903 0.82 HPGD (0.49) FAAHCNR1CNR2TSHR
SCHEMBL9500025 0.81 TSHR (0.39) FAAHACHECNR1CNR2TSHR
SCHEMBL9497917 0.81 DNM1 (0.56) FAAHDNM1TSHR
SCHEMBL18752940 0.80 RECQL (0.57) FAAHEPHX2CNR1CNR2TSHR
SCHEMBL18753010 0.79 PTPN1 (0.41) FAAHEPHX2CNR1CNR2TSHR
SCHEMBL2014567 0.79 FAAH (0.48) FAAHEPHX2TSHR
SCHEMBL20975838 0.79 KMT2A (0.47) FAAHACHETSHR

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-20180118676-A1 NITRIC OXIDE DONATING DERIVATIVES OF LATANOPROST FREE ACID NICOX S.A. (FR) 2018-05-03 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-20180118676-A1 NITRIC OXIDE DONATING DERIVATIVES OF LATANOPROST FREE ACID PTGIS, NOS2, NOS1 FAAH 233/4885DNM1 1393/4885CASP2 3346/4885

“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.