SCHEMBL1349038

SCHEMBL1349038

CC(C)N1C(=O)N(S(=O)(=O)c2ccccc2)C[C@@H]1c1cccc(-c2cccc(S(C)(=O)=O)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIA2 P42262 1/20 0.41
PKM P14618 1/20 0.39
NR1H2 P55055 13/20 0.39
NR1H3 Q13133 8/20 0.39
ALDH1A1 P00352 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
DRD2 P14416 1/20 0.36
RXRA P19793 1/20 0.36
HSP90AA1 P07900 1/20 0.35
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
DPP7 Q9UHL4 1/20 0.35

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
SCHEMBL1349036 1.00 GRIA2 (0.41) GRIA2PKMNR1H2NR1H3ALDH1A1
SCHEMBL1348629 0.91 GRIA2 (0.35) GRIA2PKMNR1H2NR1H3ALDH1A1
SCHEMBL1348963 0.91 PKM (0.39) PKMALDH1A1RAB9AKMT2ADPP4
SCHEMBL1349099 0.90 GRIA2 (0.43) GRIA2NR1H2NR1H3DRD2RXRA
SCHEMBL1347803 0.88 GRIA2 (0.44) GRIA2NR1H2NR1H3DRD2RXRA
SCHEMBL1348579 0.88 GRIA2 (0.38) GRIA2NR1H2NR1H3RXRADPP4
SCHEMBL1348838 0.87 GRIA2 (0.41) GRIA2NR1H2NR1H3DRD2RXRA
SCHEMBL1348861 0.86 PARG (0.41) GRIA2PKMALDH1A1RAB9AKMT2A
SCHEMBL1348324 0.85 NR1H2 (0.42) PKMNR1H2NR1H3RXRA
SCHEMBL1349116 0.85 ALDH1A1 (0.44) ALDH1A1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2288594-B1 IMIDAZOLIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-07-02 EP claimed
US-8063088-B2 Imidazolidine derivatives HOFFMANN-LA ROCHE INC. (US) 2011-11-22 US claimed
US-20090312382-A1 NOVEL IMIDAZOLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 US claimed
EP-2288594-B1 IMIDAZOLIDINE DERIVATIVES HOFFMANN LA ROCHE (CH) 2014-07-02 EP disclosed
US-8063088-B2 Imidazolidine derivatives HOFFMANN-LA ROCHE INC. (US) 2011-11-22 US disclosed
US-20090312382-A1 NOVEL IMIDAZOLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 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-20090312382-A1 NOVEL IMIDAZOLIDINE DERIVATIVES NR1H2, NR1H3, NR1D2 GRIA2 858/4885PKM 1863/4885NR1H2 1/4885

“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.