SCHEMBL557956

SCHEMBL557956

CCCCC(C1CCCNC1)C1CCCNC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CPN1 P15169 1/20 0.40
CPB2 Q96IY4 1/20 0.40
SIGMAR1 Q99720 1/20 0.35
HTR2A P28223 1/20 0.34
KCNH2 Q12809 1/20 0.33
DPP7 Q9UHL4 1/20 0.33
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
DNM1 Q05193 2/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL25395272 0.85 CPN1 (0.40) CPN1CPB2SIGMAR1HTR2AKCNH2
SCHEMBL23709494 0.85 CPN1 (0.40) CPN1CPB2SIGMAR1HTR2AKCNH2
SCHEMBL28035328 0.84 CPN1 (0.42) CPN1CPB2SIGMAR1HTR2AKCNH2
SCHEMBL4290504 0.82 CPN1 (0.41) CPN1CPB2SIGMAR1DPP7
SCHEMBL13285534 0.82 CPN1 (0.38) CPN1CPB2SIGMAR1HTR2AKCNH2
SCHEMBL4290481 0.82 CPN1 (0.41) CPN1CPB2SIGMAR1DPP7
SCHEMBL26489011 0.81 CPN1 (0.37) CPN1CPB2SIGMAR1HTR2AGNAI3
SCHEMBL820657 0.80 CPN1 (0.44) CPN1CPB2KCNH2
SCHEMBL9340322 0.80 CPN1 (0.40) CPN1CPB2SIGMAR1HTR2AKCNH2
SCHEMBL21725498 0.79 CPN1 (0.38) CPN1CPB2HTR2AGNAI3GNAO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2506966-B1 CATALYST AND METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2017-08-16 EP disclosed
EP-2506965-B1 CATALYST AND METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2016-11-09 EP disclosed
US-9409154-B2 Process for producing Sn-comprising catalysts BASF SE (DE) 2016-08-09 US disclosed
EP-2225029-B1 METHOD AND CATALYST FOR PRODUCING AN AMINE BASF SE (DE) 2016-08-03 EP disclosed
EP-2780109-B1 PROCESS FOR PRODUCING SN-CONTAINING CATALYSTS BASF SE (DE) 2016-04-13 EP disclosed
US-20150224480-A1 PROCESS FOR PRODUCING SN-COMPRISING CATALYSTS BASF SE (DE) 2015-08-13 US disclosed
EP-2883862-A1 Method for manufacturing amines BASF SE (DE) 2015-06-17 EP disclosed
US-9040451-B2 Process for producing Sn-comprising catalysts BASF SE (DE) 2015-05-26 US disclosed
US-8765634-B2 Processes for preparing amines and zirconium dioxide- and nickel-containing catalysts for use therein BASF SE (DE) 2014-07-01 US disclosed
US-20130310560-A1 PROCESSES FOR PREPARING AMINES AND CATALYSTS FOR USE THEREIN BASF SE (DE) 2013-11-21 US disclosed
US-20100274008-A1 METHOD FOR THE PRODUCTION OF AN AMINE BASF SE (DE) 2010-10-28 US disclosed
US-20100274011-A1 METHOD FOR THE PRODUCTION OF AN AMINE BASF SE (DE) 2010-10-28 US disclosed
US-7754922-B2 Process for preparing amines and zirconium dioxide- and nickel-containing catalysts for use therein BASF SE (DE) 2010-07-13 US disclosed
US-7750189-B2 Method for producing an amine BASF SE (DE) 2010-07-06 US disclosed
US-20100010264-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2010-01-14 US disclosed
US-20090312579-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-12-17 US disclosed
US-20090286977-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-11-19 US disclosed
US-20090275781-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-11-05 US disclosed
US-20090264652-A1 METHOD FOR PRODUCING AN AMINE BASF SE (DE) 2009-10-22 US disclosed
US-4605742-A Process for the production of piperidine MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1986-08-12 US 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 (8 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-20130310560-A1 PROCESSES FOR PREPARING AMINES AND CATALYSTS FOR USE THEREIN AOC3, SCO2, SOD1 CPN1 1513/4885CPB2 3123/4885SIGMAR1 1200/4885
US-20090312579-A1 METHOD FOR PRODUCING AN AMINE AOC3, AOC2, ADH5 CPN1 1648/4885CPB2 4150/4885SIGMAR1 842/4885
US-20100274008-A1 METHOD FOR THE PRODUCTION OF AN AMINE AOC3, AOC2, SOD1 CPN1 956/4885CPB2 3709/4885SIGMAR1 529/4885
US-20090275781-A1 METHOD FOR PRODUCING AN AMINE AOC3, AOC2, AOC1 CPN1 1193/4885CPB2 3576/4885SIGMAR1 577/4885
US-20100010264-A1 METHOD FOR PRODUCING AN AMINE AOC2, AOC3, SOD1 CPN1 1272/4885CPB2 2649/4885SIGMAR1 903/4885
US-20090286977-A1 METHOD FOR PRODUCING AN AMINE SOD1, AOC3, AOC2 CPN1 869/4885CPB2 2956/4885SIGMAR1 950/4885
US-20100274011-A1 METHOD FOR THE PRODUCTION OF AN AMINE SCO2, AOC3, AOC2 CPN1 1824/4885CPB2 2401/4885SIGMAR1 989/4885
US-20090264652-A1 METHOD FOR PRODUCING AN AMINE AOC3, ADH5, ADH1A CPN1 1427/4885CPB2 4099/4885SIGMAR1 713/4885

“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.