SCHEMBL6679015

SCHEMBL6679015

NC(N)=NCCc1ccc(N)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 4/20 0.68
HTR3E A5X5Y0 3/20 0.68
HTR3B O95264 3/20 0.68
HTR3D Q70Z44 3/20 0.68
HTR3C Q8WXA8 3/20 0.68
CA12 O43570 3/20 0.58
CA1 P00915 3/20 0.58
CA2 P00918 3/20 0.58
CA9 Q16790 3/20 0.58
GFER P55789 1/20 0.54
TSHR P16473 3/20 0.48
ADRA2A P08913 3/20 0.48
ADRA2B P18089 3/20 0.48
LMNA P02545 2/20 0.48
HIF1A Q16665 2/20 0.48
SLC22A2 O15244 1/20 0.48
SLC22A1 O15245 1/20 0.48
CYP2D6 P10635 1/20 0.48
SLC6A2 P23975 1/20 0.48
ADRA1A P35348 1/20 0.48

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
SCHEMBL3916740 0.83 HTR3A (0.68) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL3916736 0.81 HTR3A (0.66) HTR3AHTR3EHTR3BHTR3DHTR3C
[11C]Phenethylguanidine SCHEMBL837645 0.80 HTR3A (0.80) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL14763877 0.79 HTR3A (0.63) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL7635935 0.77 GRIN1 (0.54) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL3929410 0.76 HTR3E (0.59) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL3925719 0.74 ALOX15 (0.61) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL8079404 0.74 TSHR (0.58) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL2914010 0.73 GFER (0.77) GFERTSHRMAOBTDP1MAPT
SCHEMBL12110702 0.73 GFER (0.77) GFERTSHRMAOBTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3461811-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS 3M Innovative Properties Co. (US) 2019-04-03 EP disclosed
US-10239828-B2 Process for preparing guanidino-functional monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2019-03-26 US disclosed
EP-3010883-B1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS 3M INNOVATIVE PROPERTIES CO (US) 2019-02-20 EP disclosed
CN-105308021-B It is used to prepare the method for guanidine radicals functionalized monomer 3M创新有限公司 2018-05-04 CN disclosed
US-20170183299-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2017-06-29 US disclosed
US-9670149-B2 Process for preparing guanidino-functional monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-06-06 US disclosed
EP-3010883-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS 3M Innovative Properties Company (US) 2016-04-27 EP disclosed
US-20160096802-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2016-04-07 US disclosed
WO-2014204763-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-12-24 WO disclosed
EP-0914333-B1 PEPTIDE DERIVATIVES ASTRAZENECA AB (SE) 2004-11-24 EP disclosed
EP-0946589-A1 INHIBITORS OF PEPTIDE BINDING TO MHC CLASS II PROTEINS ZENECA LIMITED (GB) 1999-10-06 EP disclosed
EP-0946596-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1999-10-06 EP disclosed
EP-0932618-A1 PEPTIDE ANALOGUES CONTAINING A 7-MEMBERED LACTAM RING AstraZeneca AB (SE) 1999-08-04 EP disclosed
EP-0914333-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1999-05-12 EP disclosed
EP-0882066-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1998-12-09 EP disclosed
WO-1998025951-A1 INHIBITORS OF PEPTIDE BINDING TO MHC CLASS II PROTEINS ZENECA LIMITED (GB) 1998-06-18 WO disclosed
WO-1998023644-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1998-06-04 WO disclosed
WO-1998017680-A1 PEPTIDE ANALOGUES CONTAINING A 7-MEMBERED LACTAM RING ZENECA LIMITED (GB) 1998-04-30 WO disclosed
WO-1997046578-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1997-12-11 WO disclosed
WO-1997031023-A1 PEPTIDE DERIVATIVES ZENECA LIMITED (GB) 1997-08-28 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 (3 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-20160096802-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS GMPS, GUCY1B2, GUCY1A1 HTR3A 1499/4885HTR3E 3723/4885HTR3B 1713/4885
US-10239828-B2 Process for preparing guanidino-functional monomers GMPS, GUCY1B2, GUCY1A1 HTR3A 1499/4885HTR3E 3723/4885HTR3B 1713/4885
US-20170183299-A1 PROCESS FOR PREPARING GUANIDINO-FUNCTIONAL MONOMERS GMPS, GUCY1B2, GUCY1A1 HTR3A 1499/4885HTR3E 3723/4885HTR3B 1713/4885

“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.