SCHEMBL3987342

SCHEMBL3987342

COC(=O)Cc1c(C(=O)OC)ccn1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
NR4A2 P43354 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
HSD17B10 Q99714 2/20 0.40
POLB P06746 2/20 0.40
BRD4 O60885 1/20 0.40
GAA P10253 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38
PDGFRB P09619 1/20 0.38
FGFR1 P11362 1/20 0.38
PDGFRA P16234 1/20 0.38
FLT1 P17948 1/20 0.38
FGFR3 P22607 1/20 0.38
KDR P35968 1/20 0.38
TSHR P16473 2/20 0.37
LMNA P02545 1/20 0.37
HSP90AB1 P08238 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CFTR P13569 1/20 0.36

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
SCHEMBL10815985 0.81 CYP4F2 (0.41) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL10398085 0.80 GAA (0.38) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL10398506 0.80 GAA (0.38) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL16415357 0.80 TSHR (0.42) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL11199031 0.79 GAA (0.40) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL11202548 0.78 GAA (0.39) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL11202739 0.77 GAA (0.39) NR4A2L3MBTL1HSD17B10POLBBRD4
SCHEMBL10814009 0.75 KMT2A (0.35) KDM4ENR4A2L3MBTL1HSD17B10POLB
SCHEMBL16611515 0.75 ALDH1A1 (0.40) KDM4EHSD17B10POLBGAATSHR
SCHEMBL11195432 0.73 GAA (0.36) KDM4ENR4A2L3MBTL1HSD17B10POLB

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
US-7589206-B2 Pyrrolopyridine derivatives GLAXO GROUP LIMITED (GB) 2009-09-15 US disclosed
US-7589206-B2 Pyrrolopyridine derivatives GLAXO GROUP LIMITED (GB) 2009-09-15 US disclosed
US-7589206-B2 Pyrrolopyridine derivatives GLAXO GROUP LIMITED (GB) 2009-09-15 US disclosed
EP-1753764-B1 PYRROLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2008-10-29 EP disclosed
WO-2008116816-A1 COMBINATION OF CB2 LIGAND AND PARACETAMOL GLAXO GROUP LIMITED (GB) 2008-10-02 WO disclosed
WO-2008116816-A1 COMBINATION OF CB2 LIGAND AND PARACETAMOL GLAXO GROUP LIMITED (GB) 2008-10-02 WO disclosed
US-20070219229-A1 Pyrrolopyridine Derivatives GLAXO GROUP LIMITED (GB) 2007-09-20 US disclosed
US-20070219229-A1 Pyrrolopyridine Derivatives GLAXO GROUP LIMITED (GB) 2007-09-20 US disclosed
US-20070219229-A1 Pyrrolopyridine Derivatives GLAXO GROUP LIMITED (GB) 2007-09-20 US disclosed
EP-1753764-A1 PYRROLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2007-02-21 EP disclosed
WO-2007017264-A2 PYRROLOPYRIDINEDERIVATIVES AS MODULATORS OF THE CANNABINOID RECEPTOR FOR THE TREATMENT OF IMMUNE AND INFLAMMATORY DISORDERS GLAXO GROUP LIMITED (GB) 2007-02-15 WO disclosed
WO-2005121140-A1 PYRROLOPYRIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2005-12-22 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-20070219229-A1 Pyrrolopyridine Derivatives CNR2, CNR1, TRPV1 KDM4E 2054/4885NR4A2 750/4885L3MBTL1 4817/4885

“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.