SCHEMBL2196147

SCHEMBL2196147

Cn1nc(Cc2ccc(C(F)(F)F)cc2)[nH]c1=[Pt].IN(I)C1CC1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.41
AADAT Q8N5Z0 1/20 0.36
TYMP P19971 1/20 0.35
SIGMAR1 Q99720 2/20 0.34
CARM1 Q86X55 1/20 0.33
PRMT6 Q96LA8 1/20 0.33
MBOAT4 Q96T53 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
TMEM97 Q5BJF2 1/20 0.32
CTSS P25774 1/20 0.32
ADORA1 P30542 1/20 0.32
PHGDH O43175 1/20 0.32
IDH1 O75874 1/20 0.32
PDE2A O00408 1/20 0.32
ALKBH3 Q96Q83 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
SCHEMBL2198379 0.98 PDE5A (0.43) PDE5AAADATTYMPSIGMAR1CARM1
SCHEMBL2194720 0.97 PDE5A (0.43) PDE5AAADATTYMPSIGMAR1CARM1
SCHEMBL2195874 0.96 PDE5A (0.42) PDE5AAADATTYMPSIGMAR1CARM1
SCHEMBL2196384 0.86 PDE5A (0.36) PDE5AAADATTYMPSIGMAR1MBOAT4
SCHEMBL2193128 0.86 PDE5A (0.36) PDE5A
SCHEMBL2196259 0.85 PDE5A (0.38) PDE5AAADATTYMPSIGMAR1CARM1
SCHEMBL2193923 0.83 PDE5A (0.38) PDE5A
SCHEMBL2197113 0.83 PDE5A (0.35) PDE5AAADATTYMPSIGMAR1MBOAT4
SCHEMBL2195540 0.82 PDE5A (0.38) PDE5A
SCHEMBL2195103 0.82 PDE2A (0.35) PDE5ATYMPSIGMAR1TMEM97PDE2A

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 PDE5A 4509/4885AADAT 2536/4885TYMP 1033/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 PDE5A 4509/4885AADAT 2536/4885TYMP 1033/4885

“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.