SCHEMBL17560010

SCHEMBL17560010

COCc1cccc([N+](=O)[O-])c1COc1ccc(OC[C@H]2CCN(C(=O)O)C2)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.41
KDM1A O60341 4/20 0.41
GAA P10253 1/20 0.39
RCOR1 Q9UKL0 3/20 0.39
MAOA P21397 2/20 0.39
KDM1B Q8NB78 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
F2 P00734 1/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.37
KMT2A Q03164 2/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KDM4E B2RXH2 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
SCHEMBL17554393 1.00 MAOB (0.41) MAOBKDM1AGAARCOR1MAOA
SCHEMBL17554392 1.00 MAOB (0.41) MAOBKDM1AGAARCOR1MAOA
SCHEMBL17560013 1.00 MAOB (0.41) MAOBKDM1AGAARCOR1MAOA
SCHEMBL17560030 0.92 KDM1A (0.39) MAOBKDM1AGAARCOR1MAOA
SCHEMBL17560031 0.92 KDM1A (0.39) MAOBKDM1AGAARCOR1MAOA
SCHEMBL30388632 0.89 GPR119 (0.44) KDM1A
SCHEMBL30389105 0.89 GPR119 (0.44) KDM1A
SCHEMBL30388978 0.89 GPR119 (0.44) KDM1A
SCHEMBL17554457 0.85 KDM1A (0.42) KDM1ARCOR1MAOAKDM1BF2
SCHEMBL17559990 0.85 KDM1A (0.42) KDM1ARCOR1MAOAKDM1BF2

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-10183952-B2 Thienopyrroles as histone demethylase inhibitors ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2019-01-22 US disclosed
US-20170260197-A1 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2017-09-14 US disclosed
EP-3189059-A2 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS Istituto Europeo di Oncologia S.r.l. (IT) 2017-07-12 EP disclosed
WO-2016034946-A2 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS ISTITUTO EUROPEO DI ONCOLOGIA S.R.L. (IT) 2016-03-10 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 (2 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-10183952-B2 Thienopyrroles as histone demethylase inhibitors KDM1A, KDM1B, KDM3A MAOB 1546/4885KDM1A 1/4885GAA 3320/4885
US-20170260197-A1 THIENOPYRROLES AS HISTONE DEMETHYLASE INHIBITORS KDM1A, KDM1B, KDM3A MAOB 1546/4885KDM1A 1/4885GAA 3320/4885

“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.