SCHEMBL14701070

SCHEMBL14701070

COc1ccc(CNC2CC2c2ccc(NC(=O)c3ccc(-c4ccccc4)cc3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAOA P21397 10/20 0.73
KDM1A O60341 12/20 0.64
MAOB P27338 2/20 0.62
HDAC1 Q13547 2/20 0.57
HDAC2 Q92769 2/20 0.57
HDAC6 Q9UBN7 1/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
POLB P06746 1/20 0.53
CTDSP1 Q9GZU7 1/20 0.53

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
SCHEMBL15789221 1.00 MAOA (0.73) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL15789219 0.90 KDM1A (0.71) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL15789023 0.90 KDM1A (0.74) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL15789026 0.90 KDM1A (0.74) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL14701053 0.90 KDM1A (0.71) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL14701079 0.90 MAOA (0.75) MAOAKDM1AMAOBHDAC1
SCHEMBL15789243 0.90 MAOA (0.75) MAOAKDM1AMAOBHDAC1
SCHEMBL15789209 0.88 KDM1A (0.66) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL14701017 0.88 KDM1A (0.66) MAOAKDM1AMAOBHDAC1HDAC2
SCHEMBL14701066 0.86 KDM1A (0.67) MAOAKDM1AMAOBHDAC1HDAC2

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-2743256-B1 CYCLOPROPANEAMINE COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2018-06-27 EP disclosed
EP-2743256-B1 CYCLOPROPANEAMINE COMPOUND TAKEDA PHARMACEUTICALS CO (JP) 2018-06-27 EP disclosed
US-9682925-B2 Cyclopropaneamine compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-06-20 US disclosed
US-20160130215-A1 CYCLOPROPANEAMINE COMPOUND TAKEDA PHARMACEUTICAL (JP) 2016-05-12 US disclosed
US-9278931-B2 Cyclopropaneamine compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-03-08 US disclosed
US-20140228405-A1 CYCLOPROPANEAMINE COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-08-14 US disclosed
EP-2743256-A1 CYCLOPROPANEAMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-06-18 EP disclosed
EP-2743256-A1 CYCLOPROPANEAMINE COMPOUND Takeda Pharmaceutical Company Limited (JP) 2014-06-18 EP disclosed
WO-2013022047-A1 CYCLOPROPANEAMINE COMPOUND 武田薬品工業株式会社 (JP) 2013-02-14 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-20160130215-A1 CYCLOPROPANEAMINE COMPOUND KDM1A, KDM1B, KDM3A MAOA 101/4885KDM1A 1/4885MAOB 90/4885
US-20140228405-A1 CYCLOPROPANEAMINE COMPOUND KDM1A, KDM1B, KDM3A MAOA 101/4885KDM1A 1/4885MAOB 90/4885

“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.