SCHEMBL2198454

SCHEMBL2198454

CCn1ccn(C)c1=[Pt].FC(F)(F)c1ccc(CN(I)I)cc1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PYCR1 P32322 1/20 0.37
PDE2A O00408 1/20 0.33
KDM4E B2RXH2 3/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LSS P48449 1/20 0.33
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
TAAR1 Q96RJ0 1/20 0.31
TLR8 Q9NR97 1/20 0.31
ALDH1A1 P00352 2/20 0.31
TRPA1 O75762 1/20 0.30
IDO1 P14902 1/20 0.30
CHKA P35790 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL2196021 0.91 KDM4E (0.36) PYCR1PDE2AKDM4EGAASMN1; SMN2
SCHEMBL2194557 0.90 PYCR1 (0.41) PYCR1PDE2AKDM4ELMNAGAA
SCHEMBL2197110 0.87 PYCR1 (0.33) PYCR1LSS
SCHEMBL2195738 0.87 OPRL1 (0.40) PYCR1PDE2AKDM4ESMN1; SMN2ALDH1A1
SCHEMBL2197087 0.87 MAPT (0.43) PYCR1KDM4EGAASMN1; SMN2NPSR1
SCHEMBL2193860 0.87 KDM4E (0.36) PYCR1KDM4ESMN1; SMN2ALDH1A1
SCHEMBL2193845 0.87 POLB (0.39) KDM4ELMNAGAASMN1; SMN2ALDH1A1
SCHEMBL2197400 0.86 ALDH1A1 (0.33) PYCR1ALDH1A1
SCHEMBL2195824 0.86 PYCR1 (0.36) PYCR1PDE2AKDM4ELMNAGAA
SCHEMBL15085514 0.86 SLC6A2 (0.35) PYCR1SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8980875-B2 Platinum-N-heterocyclic carbene derivatives, preparation thereof and therapeutic use thereof CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2015-03-17 US claimed
US-20130338128-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2013-12-19 US claimed
US-8481522-B2 Platinum-N-heterocyclic carbene derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2013-07-09 US claimed
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-07-14 US claimed

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-20130338128-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 PYCR1 75/4885PDE2A 4198/4885KDM4E 4803/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 PYCR1 75/4885PDE2A 4198/4885KDM4E 4803/4885

“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.