SCHEMBL1348740

SCHEMBL1348740

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

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 3/20 0.45
CTSG P08311 2/20 0.45
AKR1C3 P42330 5/20 0.41
AKR1C1 Q04828 2/20 0.41
KMO O15229 1/20 0.40
ALDH1A1 P00352 2/20 0.40
MCL1 Q07820 1/20 0.39
MAPT P10636 1/20 0.39
IL1RN P18510 1/20 0.39
PKM P14618 1/20 0.39
PFKFB3 Q16875 1/20 0.38
RAB9A P51151 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL1348608 0.93 MCL1 (0.43) CMA1CTSGAKR1C3AKR1C1ALDH1A1
SCHEMBL1348640 0.93 CMA1 (0.44) CMA1CTSGAKR1C3AKR1C1KMO
SCHEMBL1459376 0.88 CMA1 (0.38) CMA1CTSGAKR1C3AKR1C1KMO
SCHEMBL1348509 0.86 PKM (0.37) CMA1CTSGAKR1C3AKR1C1ALDH1A1
SCHEMBL1348981 0.85 NR1H2 (0.42) ALDH1A1PKMRAB9AKMT2A
SCHEMBL15841731 0.85 BCL9 (0.38) CMA1CTSGALDH1A1PKMRAB9A
SCHEMBL15841773 0.84 BCL9 (0.37) AKR1C3AKR1C1ALDH1A1MCL1MAPT
SCHEMBL1347258 0.83 CTSG (0.46) CMA1CTSGALDH1A1MCL1PKM
SCHEMBL1348651 0.82 FFAR1 (0.43) AKR1C3AKR1C1MCL1PKM
SCHEMBL15841692 0.82 CHRNB2 (0.38) CMA1CTSGAKR1C3ALDH1A1PKM

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 10 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
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 CMA1 4479/4885CTSG 4280/4885AKR1C3 844/4885

“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.