SCHEMBL17147367

SCHEMBL17147367

O=C1NC(=O)/C(=C/c2cccc(CO)c2)S1

nearest known ligand 0.73

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.73
AKR1B1 P15121 5/20 0.68
PIM1 P11309 9/20 0.65
PIM2 Q9P1W9 9/20 0.65
CISD1 Q9NZ45 3/20 0.63
MAOA P21397 1/20 0.63
MAOB P27338 1/20 0.63
PIM3 Q86V86 1/20 0.62
GSK3B P49841 2/20 0.59
TTR P02766 1/20 0.59
IGF1R P08069 2/20 0.58
RAB9A P51151 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
PTPN1 P18031 1/20 0.56

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
SCHEMBL2626932 0.86 NAT1 (0.69) PIM1CISD1GSK3BRAB9A
SCHEMBL7465302 0.86 PIM1 (0.73) HPGDAKR1B1PIM1PIM2CISD1
SCHEMBL7465304 0.86 PIM1 (0.73) HPGDAKR1B1PIM1PIM2CISD1
SCHEMBL12107430 0.85 HPGD (1.00) HPGDAKR1B1PIM1PIM2CISD1
SCHEMBL12259747 0.81 AKR1B1 (1.00) HPGDAKR1B1PIM1PIM2CISD1
SCHEMBL1250348 0.79 PIM1 (1.00) AKR1B1PIM1PIM2CISD1MAOA
SCHEMBL2548389 0.79 PIM1 (1.00) AKR1B1PIM1PIM2CISD1MAOA
SCHEMBL1250346 0.79 PIM1 (1.00) AKR1B1PIM1PIM2CISD1MAOA
SCHEMBL1250387 0.78 PIM1 (1.00) HPGDAKR1B1PIM1PIM2CISD1
SCHEMBL2132747 0.78 PIM1 (1.00) HPGDAKR1B1PIM1PIM2CISD1

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
US-9518285-B2 Chemiluminescent compositions, methods, assays and kits for oxidative enzymes Life Technologies Corporation (US) 2016-12-13 US disclosed
US-20150284766-A1 CHEMILUMINESCENT COMPOSITIONS, METHODS, ASSAYS AND KITS FOR OXIDATIVE ENZYMES Life Technologies Corporation 2015-10-08 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 (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-20150284766-A1 CHEMILUMINESCENT COMPOSITIONS, METHODS, ASSAYS AND KITS FOR OXIDATIVE ENZYMES AOX1, CAT, LPO HPGD 266/4885AKR1B1 77/4885PIM1 2511/4885

“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.