SCHEMBL6504726

SCHEMBL6504726

COc1ccc(-c2cc(NN)nc(Cl)n2)cc1OC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
L3MBTL1 Q9Y468 1/20 0.63
AGTR1 P30556 1/20 0.56
ADORA3 P0DMS8 2/20 0.51
KDM4E B2RXH2 5/20 0.47
ALDH1A1 P00352 4/20 0.47
HSD17B10 Q99714 3/20 0.47
HPGD P15428 2/20 0.47
TSHR P16473 2/20 0.47
USP2 O75604 1/20 0.47
MAPK1 P28482 1/20 0.47
HTT P42858 1/20 0.47
ATM Q13315 1/20 0.47
MAPT P10636 3/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
GAA P10253 1/20 0.44
ACACA Q13085 1/20 0.44
NPC1 O15118 1/20 0.43

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
SCHEMBL2175274 0.80 MEN1 (0.72) MEN1KMT2AL3MBTL1AGTR1ADORA3
SCHEMBL12408679 0.79 MEN1 (0.70) MEN1KMT2AL3MBTL1AGTR1ADORA3
SCHEMBL12492356 0.75 MEN1 (0.60) MEN1KMT2AL3MBTL1ADORA3KDM4E
SCHEMBL416616 0.73 MEN1 (0.66) MEN1KMT2AL3MBTL1AGTR1KDM4E
SCHEMBL12408680 0.73 MEN1 (0.61) MEN1KMT2AL3MBTL1AGTR1KDM4E
SCHEMBL6749872 0.72 HSP90AA1 (0.61) MEN1KMT2AL3MBTL1AGTR1KDM4E
SCHEMBL25467108 0.71 AGTR1 (1.00) MEN1KMT2AL3MBTL1AGTR1KDM4E
SCHEMBL2178587 0.71 KMT2A (0.59) MEN1KMT2AL3MBTL1KDM4EALDH1A1
SCHEMBL4502579 0.70 KDM4E (0.68) MEN1KMT2AL3MBTL1AGTR1ADORA3
SCHEMBL10686590 0.70 MEN1 (0.57) MEN1KMT2AL3MBTL1AGTR1ADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1263756-C Imidazopyrimidine Derivatives and Triazolopyrimidine Derivatives BAYER AG (DE) 2006-07-12 CN disclosed
US-6911443-B2 Imidazopyrimidine derivatives and triazolopyrimidine derivatives BAYER AKTIENGESELLSCHAFT (DE) 2005-06-28 US disclosed
EP-1278750-B1 IMIDAZOPYRIMIDINE DERIVATIVES AND TRIAZOLOPYRIMIDINE DERIVATIVES BAYER HEALTHCARE AG (DE) 2004-08-04 EP disclosed
US-20040054179-A1 Imidazopyrimidine derivatives and triazolopyrimidine derivatives BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2004-03-18 US disclosed
CN-1439009-A Imidazo pyrimidine derivatives and triazolopyrimidine derivatives BAYER AG (DE) 2003-08-27 CN 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-20040054179-A1 Imidazopyrimidine derivatives and triazolopyrimidine derivatives XRCC6, XRN2, HRH2 MEN1 3675/4885KMT2A 1132/4885L3MBTL1 1969/4885

“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.