SCHEMBL6504950

SCHEMBL6504950

CCSc1nc(N)cc(-c2ccc(OC)c(OC)c2)n1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPT P10636 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MAPK1 P28482 2/20 0.45
USP2 O75604 1/20 0.45
HPGD P15428 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
ATM Q13315 1/20 0.45
HSD17B10 Q99714 1/20 0.45
DCK P27707 8/20 0.44
MAOB P27338 1/20 0.44
AGTR1 P30556 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
TP53 P04637 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
SCHEMBL1388381 0.78 DYRK1A (0.66) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5211458 0.78 PTGS2 (0.46) ALDH1A1MEN1KMT2ASMN1; SMN2MAPK1
SCHEMBL2559004 0.77 GAA (0.49) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL6496489 0.76 KDM4E (0.50) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL3526925 0.72 RAB9A (0.53) ALDH1A1MAPTMEN1KMT2ASMN1; SMN2
SCHEMBL7708794 0.71 KDM4E (0.54) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL5510767 0.69 NOS1 (0.64) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL6497433 0.68 MEN1 (0.53) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL4489879 0.68 MEN1 (0.54) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL1752782 0.67 ALDH1A1 (0.50) KDM4EALDH1A1MAPTMEN1KMT2A

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-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

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 KDM4E 1134/4885ALDH1A1 2402/4885MAPT 4537/4885

“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.