SCHEMBL3025348

SCHEMBL3025348

C[C@H](N)[C@H](c1ccccc1)P(c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ADRA2A P08913 1/20 0.47
ADRA2C P18825 1/20 0.47
LMNA P02545 1/20 0.47
HIF1A Q16665 1/20 0.47
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.45
DPP4 P27487 2/20 0.41
F2 P00734 1/20 0.41
CYP2D6 P10635 1/20 0.41
TAAR1 Q96RJ0 4/20 0.39
SLC6A2 P23975 2/20 0.39
MAOA P21397 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
CYP2A6 P11509 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39

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
SCHEMBL2967803 1.00 ADRA2A (0.47) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL2967801 1.00 ADRA2A (0.47) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL18219540 0.83 TAAR1 (0.39) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL4369978 0.83 TAAR1 (0.37) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL13211529 0.81 DPP4 (0.54) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL3022672 0.81 DPP4 (0.54) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL12700905 0.81 DPP4 (0.54) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL667241 0.81 DPP4 (0.54) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL13211530 0.81 DPP4 (0.54) ADRA2AADRA2CLMNAHIF1AKDM4E
SCHEMBL4379944 0.79 TAAR1 (0.36) ADRA2AADRA2CLMNAHIF1AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10385084-B2 Iron(II) catalysts containing tridentate PNP ligands, their synthesis, and use thereof THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2019-08-20 US disclosed
EP-3092075-A1 IRON(II) CATALYSTS CONTAINING TRIDENTATE PNP LIGANDS, THEIR SYNTHESIS, AND USE THEREOF The Governing Council Of The University Of Toronto (CA) 2016-11-16 EP disclosed
US-20160326202-A1 IRON(II) CATALYSTS CONTAINING TRIDENTATE PNP LIGANDS, THEIR SYNTHESIS, AND USE THEREOF THE GOVERNING COUNCIL OF THE UNIVERSITY OF TORONTO (CA) 2016-11-10 US disclosed
WO-2016029216-A2 METHOD FOR PRODUCING AMIDINE DERIVATIVES BIOCRYST PHARMACEUTICALS, INC. (US) 2016-02-25 WO disclosed
US-8716508-B2 Method for preparing a metal catalyst KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2014-05-06 US disclosed
US-8716508-B2 Method for preparing a metal catalyst KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2014-05-06 US disclosed
US-8658825-B2 Method for the preparation of aminophosphine ligands and their use in metal catalysts KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2014-02-25 US disclosed
US-8658825-B2 Method for the preparation of aminophosphine ligands and their use in metal catalysts KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2014-02-25 US disclosed
US-8658825-B2 Method for the preparation of aminophosphine ligands and their use in metal catalysts KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2014-02-25 US disclosed
US-20120046479-A1 METHOD FOR PREPARING A METAL CATALYST KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2012-02-23 US disclosed
US-20120046479-A1 METHOD FOR PREPARING A METAL CATALYST KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2012-02-23 US disclosed
US-20100204514-A1 METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2010-08-12 US disclosed
US-20100204514-A1 METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2010-08-12 US disclosed
US-20100204514-A1 METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2010-08-12 US disclosed
WO-2010043027-A1 METHOD FOR PREPARING A METAL CATALYST KANATA CHEMICAL TECHNOLOGIES INC. (CA) 2010-04-22 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 (4 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-10385084-B2 Iron(II) catalysts containing tridentate PNP ligands, their synthesis, and use thereof PNP, PNPO, FECH ADRA2A 4606/4885ADRA2C 4539/4885LMNA 4266/4885
US-20120046479-A1 METHOD FOR PREPARING A METAL CATALYST INPP5B, DNPEP, AOC1 ADRA2A 3212/4885ADRA2C 3796/4885LMNA 446/4885
US-20160326202-A1 IRON(II) CATALYSTS CONTAINING TRIDENTATE PNP LIGANDS, THEIR SYNTHESIS, AND USE THEREOF PNP, PNPO, FECH ADRA2A 4738/4885ADRA2C 4705/4885LMNA 3609/4885
US-20100204514-A1 METHOD FOR THE PREPARATION OF AMINOPHOSPHINE LIGANDS AND THEIR USE IN METAL CATALYSTS PNISR, PRMT9, PRMT8 ADRA2A 3778/4885ADRA2C 3934/4885LMNA 1794/4885

“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.