SCHEMBL2194836

SCHEMBL2194836

Cn1nc(Cc2ccccc2)[nH]c1=[Pt].FC(F)(F)c1ccc(CN(I)I)cc1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.35
MTOR P42345 1/20 0.34
ALKBH3 Q96Q83 2/20 0.34
NR3C1 P04150 1/20 0.34
PDE5A O76074 1/20 0.34
TYMP P19971 1/20 0.34
TMEM97 Q5BJF2 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
AR P10275 1/20 0.33
CNR2 P34972 1/20 0.33
CXCR2 P25025 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.32
POLB P06746 1/20 0.32

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
SCHEMBL2195103 1.00 PDE2A (0.35) PDE2AMTORALKBH3NR3C1PDE5A
SCHEMBL2196384 0.96 PDE5A (0.36) PDE2AALKBH3PDE5ATYMPSIGMAR1
SCHEMBL2197113 0.92 PDE5A (0.35) PDE2AALKBH3PDE5ATYMPSIGMAR1
SCHEMBL2195783 0.91 PDE2A (0.36) PDE2AALKBH3PDE5ATYMPSIGMAR1
SCHEMBL2193206 0.90 NR1H2 (0.36) PDE2APDE5ATYMPTMEM97
SCHEMBL2194207 0.90 PDE5A (0.34) PDE2AALKBH3PDE5ATYMPSIGMAR1
SCHEMBL2195930 0.90 GAA (0.34) KMT2A
SCHEMBL2196864 0.88 CACNA1G (0.36) KMT2ALMNA
SCHEMBL2199132 0.88 CYP2C19 (0.36) CNR2MEN1KMT2ALMNAPOLB
SCHEMBL2195871 0.86 CXCR2 (0.37) NR3C1TYMPCXCR2

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 5 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
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI-AVENTIS (FR) 2011-07-14 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 (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 PDE2A 4198/4885MTOR 3689/4885ALKBH3 2593/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 PDE2A 4198/4885MTOR 3689/4885ALKBH3 2593/4885

“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.