SCHEMBL1591433

SCHEMBL1591433

O=C(O)N(Cc1ccccc1)[C@@H]1Cc2ccc(Cn3cc(CO)c(C(F)(F)F)n3)cc2C1

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 17/20 0.61
AADAT Q8N5Z0 2/20 0.34
DGAT1 O75907 1/20 0.34

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
SCHEMBL1591016 1.00 GRIA2 (0.61) GRIA2AADATDGAT1
SCHEMBL1591019 1.00 GRIA2 (0.61) GRIA2AADATDGAT1
SCHEMBL1591094 0.81 GRIA2 (0.73) GRIA2
SCHEMBL1590735 0.80 GRIA2 (0.68) GRIA2AADAT
SCHEMBL1423237 0.80 GRIA2 (0.68) GRIA2AADAT
SCHEMBL7961698 0.80 GRIA2 (0.71) GRIA2
SCHEMBL1422644 0.80 GRIA2 (0.68) GRIA2AADAT
SCHEMBL7966871 0.80 GRIA2 (0.63) GRIA2
SCHEMBL1592052 0.77 CTSD (0.42)
SCHEMBL1590874 0.77 CTSD (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2297110-B1 INDANE DERIVATIVES AS AMPA RECEPTOR MODULATORS MERCK SHARP & DOHME (NL) 2015-05-20 EP disclosed
US-8536214-B2 Indane derivatives as AMPA receptor modulators N.V. ORGANON (NL) 2013-09-17 US disclosed
US-20110092539-A1 INDANE DERIVATIVES AS AMPA RECEPTOR MODULATORS N.V. ORGANON (NL) 2011-04-21 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-20110092539-A1 INDANE DERIVATIVES AS AMPA RECEPTOR MODULATORS GRIK5, GRIN3A, GRIK2 GRIA2 27/4885AADAT 327/4885DGAT1 3268/4885

“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.