SCHEMBL2193206

SCHEMBL2193206

Clc1ccc(CN(I)I)cc1.Cn1nc(Cc2ccc(C(F)(F)F)cc2)[nH]c1=[Pt]

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.36
NR1H3 Q13133 1/20 0.36
PDE2A O00408 1/20 0.35
P2RX3 P56373 1/20 0.34
FABP4 P15090 1/20 0.34
PDE5A O76074 1/20 0.34
TOP2A P11388 1/20 0.33
TYMP P19971 1/20 0.33
CNR1 P21554 1/20 0.33
NR1D1 P20393 1/20 0.33
HSD11B1 P28845 1/20 0.32
KCNH2 Q12809 1/20 0.32
TMEM97 Q5BJF2 1/20 0.32
RORC P51449 1/20 0.32
CCR1 P32246 1/20 0.32
MBOAT4 Q96T53 2/20 0.31
HSP90B1 P14625 1/20 0.31
TRAP1 Q12931 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
SCHEMBL2196384 0.94 PDE5A (0.36) PDE2APDE5ATYMPMBOAT4
SCHEMBL2197113 0.91 PDE5A (0.35) PDE2APDE5ATYMPMBOAT4
SCHEMBL2194836 0.90 PDE2A (0.35) PDE2APDE5ATYMPTMEM97
SCHEMBL2195103 0.90 PDE2A (0.35) PDE2APDE5ATYMPTMEM97
SCHEMBL2195783 0.90 PDE2A (0.36) PDE2APDE5ATYMPMBOAT4
SCHEMBL2194207 0.89 PDE5A (0.34) PDE2APDE5ATYMPMBOAT4
SCHEMBL2196817 0.87 NR1H2 (0.36) NR1H2NR1H3HSD11B1TMEM97
SCHEMBL2196147 0.81 PDE5A (0.41) PDE2APDE5ATYMPTMEM97MBOAT4
SCHEMBL2198379 0.81 PDE5A (0.43) PDE5ATYMPTMEM97
SCHEMBL2194720 0.81 PDE5A (0.43) PDE5ATYMPTMEM97

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 NR1H2 1458/4885NR1H3 1182/4885PDE2A 4198/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 NR1H2 1458/4885NR1H3 1182/4885PDE2A 4198/4885

“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.