SCHEMBL2193944

SCHEMBL2193944

Clc1ccc(CN(I)I)cc1.Cn1c(=O)c2c(n(C)c1=O)n(C)c(=[Pt])n2C

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.43
LMNA P02545 1/20 0.43
ALDH1A1 P00352 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
MAOB P27338 8/20 0.41
MAOA P21397 5/20 0.41
TSHR P16473 2/20 0.38
RAB9A P51151 1/20 0.38
MAPT P10636 3/20 0.38
ATM Q13315 1/20 0.36
PDE3B Q13370 1/20 0.36
PDE3A Q14432 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL2196818 0.89 ALDH1A1 (0.40) MAPK1LMNAALDH1A1NPSR1MAOB
SCHEMBL2196502 0.88 MAOB (0.41) ALDH1A1MAOBMAOATSHRMAPT
SCHEMBL2195971 0.88 HTT (0.41) MAPK1LMNAMAOBMAOATSHR
SCHEMBL2194634 0.88 TSHR (0.41) MAPK1LMNAALDH1A1NPSR1MAOB
SCHEMBL2196160 0.85 MAOB (0.42) MAOBMAOA
SCHEMBL2197721 0.83 HTT (0.35) ALDH1A1MAOBMAOATSHRMAPT
SCHEMBL15085518 0.75 ADORA2B (0.39) MAPK1LMNAALDH1A1TSHRPOLB
SCHEMBL2195641 0.73 RAB9A (0.40) MAPK1ALDH1A1TSHRRAB9A
SCHEMBL2195803 0.71 LSS (0.37) ALDH1A1RAB9A
SCHEMBL2196159 0.70 CYP19A1 (0.39) LMNARAB9AMAPT

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 MAPK1 3174/4885LMNA 2301/4885ALDH1A1 1989/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 MAPK1 3174/4885LMNA 2301/4885ALDH1A1 1989/4885

“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.