SCHEMBL2195803

SCHEMBL2195803

Clc1ccc(CN(I)I)cc1.Cn1ccn(C)c1=[Pt]

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LSS P48449 3/20 0.37
PYCR1 P32322 1/20 0.37
RAB9A P51151 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HTT P42858 1/20 0.36
SIGMAR1 Q99720 5/20 0.33
CNR2 P34972 2/20 0.33
CNR1 P21554 1/20 0.33
AOC3 Q16853 1/20 0.33
CYP19A1 P11511 1/20 0.32
NPC1 O15118 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
SCHEMBL2195234 0.88 LSS (0.33) LSSPYCR1RAB9AALDH1A1HTT
SCHEMBL2195750 0.87 LSS (0.32) LSSPYCR1RAB9AALDH1A1HTT
SCHEMBL2193788 0.87 LSS (0.32) LSSPYCR1RAB9AALDH1A1HTT
SCHEMBL2196796 0.86 LSS (0.32) LSSPYCR1RAB9AALDH1A1HTT
SCHEMBL2192772 0.85 CYP19A1 (0.34) LSSRAB9AALDH1A1SIGMAR1CNR2
SCHEMBL2196075 0.85 LSS (0.39) LSSPYCR1
SCHEMBL2196106 0.85 CYP2C19 (0.37) PYCR1ALDH1A1CNR2CNR1CYP19A1
SCHEMBL2196894 0.84 MEN1 (0.31) LSSRAB9AALDH1A1NPC1
SCHEMBL2197471 0.83 ESR1 (0.38) PYCR1ALDH1A1AOC3CYP19A1
SCHEMBL2197038 0.83 PYCR1 (0.37) PYCR1ALDH1A1HTTSIGMAR1CYP19A1

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 LSS 4688/4885PYCR1 75/4885RAB9A 1440/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 LSS 4688/4885PYCR1 75/4885RAB9A 1440/4885

“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.