SCHEMBL2544039

SCHEMBL2544039

O=C1NC(=O)/C(=C\c2ccc(Cl)cc2)S1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 10/20 1.00
PIM2 Q9P1W9 9/20 1.00
MYC P01106 1/20 0.75
NAT1 P18440 1/20 0.75
MAX P61244 1/20 0.75
PIM3 Q86V86 1/20 0.70
IGF1R P08069 2/20 0.70
HPGD P15428 2/20 0.68
RAB9A P51151 2/20 0.68
GSK3B P49841 2/20 0.68
MAOA P21397 2/20 0.68
AKR1B1 P15121 2/20 0.68
TDP1 Q9NUW8 1/20 0.68
MAOB P27338 1/20 0.68
NPC1 O15118 1/20 0.66
HTT P42858 1/20 0.66
CISD1 Q9NZ45 2/20 0.66

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
SCHEMBL261187 1.00 PIM1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL261188 1.00 PIM1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL7559786 0.95 PIM1 (0.90) PIM1PIM2MYCNAT1MAX
SCHEMBL7559789 0.95 PIM1 (0.90) PIM1PIM2MYCNAT1MAX
SCHEMBL1250231 0.87 PIM1 (0.77) PIM1PIM2NAT1PIM3IGF1R
SCHEMBL1250232 0.87 PIM1 (0.77) PIM1PIM2NAT1PIM3IGF1R
SCHEMBL1249067 0.86 NAT1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL20816059 0.86 NAT1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL1249069 0.86 NAT1 (1.00) PIM1PIM2MYCNAT1MAX
SCHEMBL1250348 0.84 PIM1 (1.00) PIM1PIM2PIM3IGF1RGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110263664-A1 Inhibitors of PIM-1 Protein Kinases, Compositions and Methods for Treating Prostate Cancer MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2011-10-27 US disclosed
EP-2217235-A2 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER Musc Foundation for Research Development (US) 2010-08-18 EP disclosed
WO-2009064486-A2 INHIBITORS OF PIM PROTEIN KINASES, COMPOSITIONS, AND METHODS FOR TREATING CANCER MUSC FOUNDATION FOR RESEARCH DEVELOPMENT (US) 2009-05-22 WO 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 (1 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-20110263664-A1 Inhibitors of PIM-1 Protein Kinases, Compositions and Methods for Treating Prostate Cancer PIM1, PIM2, PIM3 PIM1 1/4885PIM2 2/4885MYC 4/4885

“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.