SCHEMBL1349030

SCHEMBL1349030

CS(=O)(=O)c1cccc(-c2cccc(C3CN(S(=O)(=O)c4ccccc4)CC(=O)N3c3ccccc3)c2)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 13/20 0.41
NR1H3 Q13133 11/20 0.41
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
ALDH1A1 P00352 3/20 0.39
USP2 O75604 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HIF1A Q16665 1/20 0.39
HSD17B10 Q99714 1/20 0.39
PKM P14618 1/20 0.38
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
POLB P06746 1/20 0.36
MCL1 Q07820 1/20 0.36

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
SCHEMBL1349414 0.85 CTSG (0.47) ALDH1A1USP2HPGDMAPK1SMN1; SMN2
SCHEMBL1348981 0.83 NR1H2 (0.42) NR1H2NR1H3PTGS1PTGS2ALDH1A1
SCHEMBL1347358 0.83 MMP2 (0.44) ALDH1A1PKMRAB9AKMT2AESR1
SCHEMBL1346988 0.81 NR1H2 (0.44) NR1H2NR1H3ALDH1A1USP2HPGD
SCHEMBL1348530 0.76 LMNA (0.48) NR1H2NR1H3MAPK1HSD17B10KMT2A
SCHEMBL1348917 0.76 GRIA2 (0.43) NR1H2NR1H3PTGS1PTGS2ALDH1A1
SCHEMBL1347178 0.74 AKR1C3 (0.44) NR1H2NR1H3ALDH1A1USP2
SCHEMBL1347181 0.74 AKR1C3 (0.44) NR1H2NR1H3ALDH1A1USP2
SCHEMBL1349430 0.74 AKR1C3 (0.44) NR1H2NR1H3ALDH1A1USP2
SCHEMBL1349434 0.74 AKR1C3 (0.44) NR1H2NR1H3ALDH1A1USP2

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 9 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
EP-2288594-A1 IMIDAZOLIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2011-03-02 EP claimed
US-20090312382-A1 NOVEL IMIDAZOLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 US claimed
WO-2009150109-A1 IMIDAZOLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 WO 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
EP-2288594-A1 IMIDAZOLIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2011-03-02 EP disclosed
US-20090312382-A1 NOVEL IMIDAZOLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 US disclosed
WO-2009150109-A1 IMIDAZOLIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2009-12-17 WO 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 NR1H2 1/4885NR1H3 2/4885PTGS1 1716/4885

“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.