SCHEMBL5629366

SCHEMBL5629366

COC(=O)c1cc(N)cc(N)c1C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.63
MEN1 O00255 1/20 0.63
KMT2A Q03164 1/20 0.63
TDP1 Q9NUW8 1/20 0.63
GAA P10253 6/20 0.50
ALDH1A1 P00352 6/20 0.50
MAPT P10636 4/20 0.50
HSD17B10 Q99714 3/20 0.50
HPGD P15428 3/20 0.50
TSHR P16473 2/20 0.50
ALOX15 P16050 1/20 0.50
GLA P06280 2/20 0.49
ATM Q13315 2/20 0.49
CASP1 P29466 1/20 0.49
CASP7 P55210 1/20 0.49
CFTR P13569 3/20 0.48
ABL1 P00519 1/20 0.47
POLB P06746 2/20 0.42
NQO2 P16083 2/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL2811429 0.90 GAA (0.53) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL524175 0.85 GAA (0.49) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL6824936 0.85 KDM4E (0.50) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL18829858 0.83 CA12 (0.50) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL1271994 0.83 KDM4E (0.61) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL31615975 0.82 KDM4E (0.52) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL20334144 0.81 KDM4E (0.47) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL12499964 0.81 KDM4E (0.47) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL13280597 0.81 KDM4E (0.51) KDM4EMEN1KMT2ATDP1GAA
SCHEMBL20503830 0.81 GAA (0.46) KDM4EMEN1KMT2ATDP1GAA

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-20070082912-A1 Pyrrole compounds for the treatment of prostaglandine mediated diseases GLAXO GROUP LIMITED (GB) 2007-04-12 US disclosed
EP-1509499-A1 PYRROLE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2005-03-02 EP disclosed
WO-2003101959-A1 PYRROLE COMPOUNDS FOR THE TREATMENT OF PROSTAGLANDIN MEDIATED DISEASES GLAXO GROUP LIMITED (GB) 2003-12-11 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-20070082912-A1 Pyrrole compounds for the treatment of prostaglandine mediated diseases PTGER1, PTGDR, PTGIR KDM4E 1761/4885MEN1 1556/4885KMT2A 2989/4885

“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.