SCHEMBL14701053

SCHEMBL14701053

O=C(Nc1ccc(C2CC2NCc2ccc(-c3ccccc3)cc2)cc1)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 13/20 0.71
MAOA P21397 14/20 0.63
HDAC1 Q13547 2/20 0.63
HDAC2 Q92769 2/20 0.63
HDAC6 Q9UBN7 1/20 0.63
MAOB P27338 5/20 0.60
RCOR1 Q9UKL0 2/20 0.56
KDM1B Q8NB78 1/20 0.56

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
SCHEMBL15789219 1.00 KDM1A (0.71) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789023 0.95 KDM1A (0.74) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789026 0.95 KDM1A (0.74) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789076 0.93 KDM1A (0.72) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789077 0.93 KDM1A (0.72) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789108 0.90 KDM1A (0.67) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789105 0.90 KDM1A (0.67) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789335 0.90 KDM1A (0.62) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789336 0.90 KDM1A (0.62) KDM1AMAOAHDAC1HDAC2HDAC6
SCHEMBL15789221 0.90 MAOA (0.73) KDM1AMAOAHDAC1HDAC2HDAC6

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 13 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-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-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-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
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 KDM1A 1/4885MAOA 101/4885HDAC1 50/4885
US-20140228405-A1 CYCLOPROPANEAMINE COMPOUND KDM1A, KDM1B, KDM3A KDM1A 1/4885MAOA 101/4885HDAC1 50/4885

“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.