SCHEMBL2393407

SCHEMBL2393407

CC1(C)C(C(N)=O)C1c1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 9/20 0.68
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM1A O60341 4/20 0.38
MAOA P21397 4/20 0.38
MAOB P27338 4/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
HTT P42858 1/20 0.37
SLC6A4 P31645 1/20 0.37
ATM Q13315 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
SCHEMBL3288310 1.00 SLC9A1 (0.68) SLC9A1MAPTKMT2AKDM1AMAOA
SCHEMBL3288307 1.00 SLC9A1 (0.68) SLC9A1MAPTKMT2AKDM1AMAOA
Bicarbonate SCHEMBL3663569 0.93 SLC9A1 (0.60) SLC9A1MAPTKMT2AKDM1AMAOA
Bicarbonate SCHEMBL3663565 0.93 SLC9A1 (0.60) SLC9A1MAPTKMT2AKDM1AMAOA
Bicarbonate SCHEMBL3663566 0.93 SLC9A1 (0.60) SLC9A1MAPTKMT2AKDM1AMAOA
SCHEMBL18927360 0.84 SLC9A1 (0.62) SLC9A1MAPTKMT2ALMNACYP1A2
SCHEMBL16819920 0.84 SLC9A1 (0.62) SLC9A1MAPTKMT2ALMNACYP1A2
SCHEMBL3287837 0.84 SLC9A1 (0.62) SLC9A1MAPTKMT2ALMNACYP1A2
SCHEMBL3287845 0.84 SLC9A1 (0.62) SLC9A1MAPTKMT2ALMNACYP1A2
SCHEMBL3655655 0.84 SLC9A1 (0.62) SLC9A1MAPTKMT2ALMNACYP1A2

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103373911-B Single fluoro cyclopropanes compound and its preparation method and application 中国科学院上海有机化学研究所 2016-12-14 CN disclosed
CN-104884432-A Alpha7 nicotinic acetylcholine receptor modulators and uses thereof-I MERCK SHARP & DOHME 2015-09-02 CN disclosed
CN-101495444-B A process for the preparation of optically active cyclopropylamines ASTRAZENECA SWEDEN AB 2015-02-04 CN disclosed
CN-104119246-A Cyclopropane derivatives, and preparation method and application thereof SHANGHAI INST ORGANIC CHEM 2014-10-29 CN disclosed
EP-2207540-B1 CYCLOPROPYL ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2014-02-26 EP disclosed
EP-2207540-B1 CYCLOPROPYL ARYL AMIDE DERIVATIVES AND USES THEREOF HOFFMANN LA ROCHE (CH) 2014-02-26 EP disclosed
CN-103373911-A Monofluorocyclopropane compounds as well as preparation method and application for same SHANGHAI INST ORGANIC CHEM 2013-10-30 CN disclosed
EP-2644591-A1 Optically active 2-aryl cyclopropane carboxamide intermediates Astrazeneca AB (SE) 2013-10-02 EP disclosed
CN-101815512-B Cyclopropyl aryl amide derivatives and uses thereof HOFFMANN LA ROCHE 2013-04-24 CN disclosed
US-8278475-B2 Processes for the preparation of optically active intermediates ASTRAZENECA AB (SE) 2012-10-02 US disclosed
US-7723391-B2 Cyclopropyl aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2010-05-25 US disclosed
US-7723391-B2 Cyclopropyl aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2010-05-25 US disclosed
CN-101495444-A A process for the preparation of optically active cyclopropylamines ASTRAZENECA AB (SE) 2009-07-29 CN disclosed
EP-2049463-A1 A PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE CYCLOPROPYLAMINES Astra Zeneca AB (SE) 2009-04-22 EP disclosed
US-20090093525-A1 Cyclopropyl aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 US disclosed
US-20090093525-A1 Cyclopropyl aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 US disclosed
US-20090093525-A1 Cyclopropyl aryl amide derivatives and uses thereof ROCHE PALO ALTO LLC 2009-04-09 US disclosed
WO-2009043784-A1 CYCLOPROPYL ARYL AMIDE DERIVATIVES AND USES THEREOF F. HOFFMANN-LA ROCHE AG (CH) 2009-04-09 WO disclosed
US-20080071114-A1 Processes For The Preparation Of Optically Active Intermediates ASTRAZENECA AB (SE) 2008-03-20 US disclosed
WO-2008018823-A1 A PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE CYCLOPROPYLAMINES ASTRAZENECA AB (SE) 2008-02-14 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-20080071114-A1 Processes For The Preparation Of Optically Active Intermediates DHPS, CYP1B1, CYP2S1 SLC9A1 4551/4885MAPT 2852/4885KMT2A 3608/4885
US-20090093525-A1 Cyclopropyl aryl amide derivatives and uses thereof AR, ADRA2A, ADRA1A SLC9A1 3094/4885MAPT 2449/4885KMT2A 2189/4885

“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.