SCHEMBL10105148

SCHEMBL10105148

C=C1N(C)C=CN1Cc1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.40
SIGMAR1 Q99720 2/20 0.38
ELANE P08246 2/20 0.36
F2 P00734 1/20 0.36
PLG P00747 1/20 0.36
CTSG P08311 1/20 0.36
CMA1 P23946 1/20 0.36
CTRC Q99895 1/20 0.36
LMNA P02545 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TSHR P16473 1/20 0.36
CCR3 P51677 1/20 0.36
CYP19A1 P11511 2/20 0.35
POLB P06746 1/20 0.35
GSK3A P49840 2/20 0.35
GSK3B P49841 2/20 0.35
CCNB2 O95067 1/20 0.35
CDK1 P06493 1/20 0.35
CCNB1 P14635 1/20 0.35
CCNB3 Q8WWL7 1/20 0.35

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
SCHEMBL1078286 0.72 SIGMAR1 (0.48) MC4RSIGMAR1ELANEF2PLG
SCHEMBL29272014 0.67 MC4R (0.41) MC4RSIGMAR1ELANEF2PLG
SCHEMBL23131277 0.65 GSK3A (0.34) LMNAGSK3AGSK3B
SCHEMBL28659205 0.64 SIGMAR1 (0.50) MC4RSIGMAR1ELANEF2PLG
SCHEMBL4084451 0.64 LMNA (0.45) MC4RSIGMAR1ELANEF2PLG
SCHEMBL24701942 0.64 LMNA (0.39) MC4RSIGMAR1ELANEF2PLG
Hydrochloric Acid SCHEMBL29906145 0.64 GSK3A (0.37) SIGMAR1ELANEF2PLGCTSG
SCHEMBL14812572 0.63 ELANE (0.42) MC4RSIGMAR1ELANEF2PLG
SCHEMBL22172085 0.62 ELANE (0.50) ELANEF2PLGCTSGCMA1
SCHEMBL4308587 0.61 LMNA (0.39) MC4RSIGMAR1ELANEF2PLG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012085475-A1 NOVEL PLATINUM-CARBENE COMPLEXES AND USE THEREOF AS MEDICAMENTS CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-06-28 WO disclosed
WO-2012085479-A1 PROCESS FOR PREPARING PLATINUM-CARBENE COMPLEXES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2012-06-28 WO disclosed