SCHEMBL9609773

SCHEMBL9609773

COC(=O)Cn1cc(C)ccc1=O

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.67
ALDH1A1 P00352 4/20 0.67
POLB P06746 3/20 0.67
MAPT P10636 1/20 0.67
SMN1; SMN2 Q16637 3/20 0.44
HSD17B10 Q99714 2/20 0.44
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.43
PDE10A Q9Y233 1/20 0.43
KAT2B Q92831 1/20 0.41
PLK1 P53350 1/20 0.40

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
SCHEMBL2824926 0.85 ALDH1A1 (0.65) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL26105379 0.81 GAA (0.46) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL27033898 0.81 ALDH1A1 (0.48) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL27033354 0.81 LMNA (0.57) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL13837880 0.81 KMT2A (0.47) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL23520538 0.81 KDM4E (0.44) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL4591133 0.80 KDM4E (1.00) KDM4EALDH1A1POLBMAPTSMN1; SMN2
Hydrochloric Acid SCHEMBL26105494 0.80 GAA (0.44) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL15468963 0.79 MAPT (0.44) KDM4EALDH1A1POLBMAPTSMN1; SMN2
SCHEMBL2825710 0.78 KDM4E (0.65) KDM4EALDH1A1POLBMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2880033-B1 CYCLIC UREA- OR LACTAM-SUBSTITUTED QUINOXALINE-TYPE PIPERIDINE COMPOUNDS AND THE USES THEREOF PURDUE PHARMA LP (US) 2020-06-17 EP disclosed
US-9085561-B2 Cyclic urea- or lactam-substituted quinoxaline-type piperidines as ORL-1 modulators PURDUE PHARMA L.P. (US) 2015-07-21 US disclosed
US-8921243-B2 Fabrics comprising a photocatalyst to produce singlet oxygen from ambient oxygen VENTANA RESEARCH CORPORATION 2014-12-30 US disclosed
US-8921243-B2 Fabrics comprising a photocatalyst to produce singlet oxygen from ambient oxygen VENTANA RESEARCH CORPORATION 2014-12-30 US disclosed
US-8481446-B2 Chemically-resistant coating composition VENTANA RESEARCH CORPORATION 2013-07-09 US disclosed
US-8481446-B2 Chemically-resistant coating composition VENTANA RESEARCH CORPORATION 2013-07-09 US disclosed
US-20120135651-A1 Fabrics Comprising a Photocatalyst to Produce Singlet Oxygen from Ambient Oxygen VENTANA RESEARCH CORPORATION 2012-05-31 US disclosed
US-20120135651-A1 Fabrics Comprising a Photocatalyst to Produce Singlet Oxygen from Ambient Oxygen VENTANA RESEARCH CORPORATION 2012-05-31 US disclosed
WO-2011142838-A2 CHEMICALLY-RESISTANT COATING COMPOSITION LOMBARID JOHN L (US) 2011-11-17 WO disclosed
US-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION VENTANA RESEARCH CORPORATION 2010-11-04 US disclosed
US-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION VENTANA RESEARCH CORPORATION 2010-11-04 US disclosed
WO-2010118180-A1 FABRICS COMPRISING A PHOTOCATALYST TO PRODUCE SINGLET OXYGEN FROM AMBIENT OXYGEN LOMBARDI JOHN L (US) 2010-10-14 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-20100279850-A1 CHEMICALLY-RESISTANT COATING COMPOSITION DNMT1, VCL, DNMT3L KDM4E 173/4885ALDH1A1 1103/4885POLB 1463/4885

“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.