SCHEMBL2196106

SCHEMBL2196106

Cc1ccc(CN(I)I)cc1.Cn1ccn(C)c1=[Pt]

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.37
PYCR1 P32322 1/20 0.35
MAPT P10636 2/20 0.33
BRD4 O60885 1/20 0.33
TP53 P04637 1/20 0.33
CYP19A1 P11511 2/20 0.33
PKM P14618 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
ALDH1A1 P00352 1/20 0.33
IDO1 P14902 1/20 0.32
CNR2 P34972 3/20 0.32
CNR1 P21554 1/20 0.31
CYP11B1 P15538 1/20 0.31
CYP11B2 P19099 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
SCHEMBL2195476 0.87 TSHR (0.32)
SCHEMBL2196946 0.87 TP53 (0.31) MAPTTP53
SCHEMBL2194553 0.85 BRD4 (0.31) BRD4ALDH1A1
SCHEMBL2197038 0.85 PYCR1 (0.37) PYCR1CYP19A1ALDH1A1
SCHEMBL2195803 0.85 LSS (0.37) PYCR1CYP19A1ALDH1A1CNR2CNR1
SCHEMBL2197471 0.85 ESR1 (0.38) PYCR1CYP19A1ALDH1A1
SCHEMBL2194426 0.84 SLC6A2 (0.31) HRH3
SCHEMBL2196788 0.84 CYP2C19 (0.36) CYP2C19TP53CYP19A1ALDH1A1CNR2
SCHEMBL2195398 0.84 TSHR (0.41) CYP2C19ALDH1A1CNR2
SCHEMBL2197608 0.83 TP53 (0.32) MAPTTP53CNR2

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 CYP2C19 255/4885PYCR1 75/4885MAPT 4712/4885
US-20110172199-A1 PLATINUM-N-HETEROCYCLIC CARBENE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SCO2, C3AR1, IDH1 CYP2C19 255/4885PYCR1 75/4885MAPT 4712/4885

“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.