SCHEMBL527073

SCHEMBL527073

CC(C)(C)N(C(=O)O)[C@@H]1C[C@H]1c1ccc(Br)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.40
MAOB P27338 3/20 0.40
KCNH2 Q12809 2/20 0.40
RCOR1 Q9UKL0 2/20 0.40
KDM1B Q8NB78 1/20 0.40
HTR2C P28335 2/20 0.39
HTR2B P41595 2/20 0.39
MAOA P21397 2/20 0.36
SLC6A4 P31645 4/20 0.36
SLC6A3 Q01959 4/20 0.36
SLC6A2 P23975 3/20 0.35
PRCP P42785 1/20 0.35

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
SCHEMBL2215832 1.00 KDM1A (0.40) KDM1AMAOBKCNH2RCOR1KDM1B
SCHEMBL14841626 0.86 KDM1A (0.38) KDM1AMAOA
SCHEMBL1524298 0.86 KDM1A (0.38) KDM1AMAOA
SCHEMBL1029213 0.86 MAOA (0.46) KDM1AMAOBKCNH2RCOR1HTR2C
SCHEMBL1029212 0.86 MAOA (0.46) KDM1AMAOBKCNH2RCOR1HTR2C
SCHEMBL13583843 0.86 RXRA (0.48) KDM1AMAOBMAOA
SCHEMBL7132779 0.85 DRD2 (0.44) HTR2CHTR2BSLC6A4SLC6A3SLC6A2
SCHEMBL7132775 0.85 DRD2 (0.44) HTR2CHTR2BSLC6A4SLC6A3SLC6A2
SCHEMBL17550724 0.85 MAOA (0.35) KDM1AMAOA
SCHEMBL17960615 0.85 MAOA (0.37) KDM1AMAOBRCOR1KDM1BMAOA

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9149447-B2 Lysine specific demethylase-1 inhibitors and their use ORYZON GENOMICS S.A. (ES) 2015-10-06 US disclosed
US-8946296-B2 Substituted heteroaryl- and aryl-cyclopropylamine acetamides and their use ORYZON GENOMICS S.A. (ES) 2015-02-03 US disclosed
US-8859555-B2 Lysine Specific Demethylase-1 inhibitors and their use ORYZON GENOMICS S.A. (ES) 2014-10-14 US disclosed
US-20140213657-A1 LYSINE SPECIFIC DEMETHYLASE-1 INHIBITORS AND THEIR USE ORYZON GENOMICS S.A. (ES) 2014-07-31 US disclosed
US-8524717-B2 Oxidase inhibitors and their use ORYZON GENOMICS, S.A. (ES) 2013-09-03 US disclosed
US-20120283266-A1 LYSINE SPECIFIC DEMETHYLASE-1 INHIBITORS AND THEIR USE ORYZON GENOMICS S.A. (ES) 2012-11-08 US disclosed
US-20120264823-A1 SUBSTITUTED HETEROARYL- AND ARYL-CYCLOPROPYLAMINE ACETAMIDES AND THEIR USE ORYZON GENOMICS S.A. 2012-10-18 US disclosed
US-20110263604-A1 Oxidase inhibitors and their use ORYZON GENOMICS, S.A. (ES) 2011-10-27 US disclosed
WO-2011131697-A1 LYSINE SPECIFIC DEMETHYLASE-1 INHIBITORS AND THEIR USE ORYZON GENOMICS S.A. (ES) 2011-10-27 WO disclosed
EP-2361242-A1 OXIDASE INHIBITORS AND THEIR USE Oryzon Genomics, S.A. (ES) 2011-08-31 EP disclosed
EP-1848695-B1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LTD (GB) 2011-07-27 EP disclosed
WO-2011042217-A1 SUBSTITUTED HETEROARYL- AND ARYL- CYCLOPROPYLAMINE ACETAMIDES AND THEIR USE ORYZON GENOMICS S.A. (ES) 2011-04-14 WO disclosed
WO-2011035941-A1 LYSINE SPECIFIC DEMETHYLASE-1 INHIBITORS AND THEIR USE ORYZON GENOMICS S.A. (ES) 2011-03-31 WO disclosed
US-7790758-B2 glutamate receptors agonists; especially to treat psychotic conditions, including schizophrenia and enhancement of cognition; N-{-2-[4-(6-fluoro-3-pyridinyl)phenyl]cyclopropyl}-2-propanesulfonamide; stereoselectively epoxidising a suitable styrene; coupling with boronic acid derivatives GLAXO GROUP LIMITED (GB) 2010-09-07 US disclosed
US-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GLAXO GROUP LIMITED (GB) 2008-07-10 US disclosed
EP-1848695-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-10-31 EP disclosed
WO-2006087169-A1 COMPOUNDS WHICH POTENTIATE GLUTAMATE RECEPTOR AND USES THEREOF IN MEDICINE GLAXO GROUP LIMITED (GB) 2006-08-24 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 (5 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-20110263604-A1 Oxidase inhibitors and their use MAOA, PNPO, MAOB KDM1A 920/4885MAOB 3/4885KCNH2 2084/4885
US-20120283266-A1 LYSINE SPECIFIC DEMETHYLASE-1 INHIBITORS AND THEIR USE JMJD6, KDM3A, KDM1A KDM1A 3/4885MAOB 186/4885KCNH2 494/4885
US-20120264823-A1 SUBSTITUTED HETEROARYL- AND ARYL-CYCLOPROPYLAMINE ACETAMIDES AND THEIR USE CBR1, CNR1, CBR3 KDM1A 877/4885MAOB 569/4885KCNH2 1511/4885
US-20080167351-A1 Compounds Which Potentiate Glutamate Receptor and Uses Thereof in Medicine GRIN1, GRM2, GRM1 KDM1A 3326/4885MAOB 1930/4885KCNH2 1321/4885
US-20140213657-A1 LYSINE SPECIFIC DEMETHYLASE-1 INHIBITORS AND THEIR USE KDM1A, KDM1B, KDM3A KDM1A 1/4885MAOB 244/4885KCNH2 656/4885

“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.