SCHEMBL1497397

SCHEMBL1497397

O=C(NC12CC3CC(C1)C(S)C(C3)C2)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 4/20 0.53
CNR2 P34972 3/20 0.53
EPHX2 P34913 6/20 0.51
CNR1 P21554 1/20 0.50
FKBP1A P62942 2/20 0.49
KMT2A Q03164 3/20 0.49
MEN1 O00255 2/20 0.49
ALDH1A1 P00352 2/20 0.49
MAPK1 P28482 1/20 0.49
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
EPHX1 P07099 1/20 0.44
CTSL P07711 1/20 0.42
CTSB P07858 1/20 0.42
CTSS P25774 1/20 0.42

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
SCHEMBL1556682 0.89 EPHX2 (0.52) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL13575194 0.89 EPHX2 (0.52) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL13575195 0.89 EPHX2 (0.52) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL973910 0.88 EPHX2 (0.51) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL974457 0.88 EPHX2 (0.51) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL10297219 0.88 EPHX2 (0.51) FAAHCNR2EPHX2CNR1FKBP1A
Hydrochloric Acid SCHEMBL973909 0.87 EPHX2 (0.50) FAAHCNR2EPHX2CNR1FKBP1A
Hydrochloric Acid SCHEMBL973908 0.87 EPHX2 (0.50) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL10297217 0.86 EPHX2 (0.49) FAAHCNR2EPHX2CNR1FKBP1A
SCHEMBL10131882 0.86 EPHX2 (0.49) FAAHCNR2EPHX2CNR1FKBP1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8440720-B2 Methods of use of antiviral compounds INFLUMEDIX, INC. (US) 2013-05-14 US disclosed
US-8440720-B2 Methods of use of antiviral compounds INFLUMEDIX, INC. (US) 2013-05-14 US disclosed
US-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 US disclosed
US-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS INFLUMEDIX, INC. 2011-03-17 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-20110065766-A1 METHODS OF USE OF ANTIVIRAL COMPOUNDS MAVS, SLC30A5, HAVCR2 FAAH 2661/4885CNR2 3873/4885EPHX2 3743/4885

“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.