SCHEMBL6326519

SCHEMBL6326519

N=C(N)c1cc2ccc(O)cc2n2nnnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F12 P00748 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CUL4A Q13619 1/20 0.34
ALDH1A1 P00352 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
HTR2A P28223 3/20 0.32
HTR2C P28335 3/20 0.32
HTR2B P41595 3/20 0.32
TOP1 P11387 1/20 0.31
CYP2C9 P11712 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
USP2 O75604 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
TLR9 Q9NR96 1/20 0.31

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
SCHEMBL4487724 0.83 KMT2A (0.54) MEN1KMT2ACUL4AALDH1A1MAPT
SCHEMBL4497379 0.69 MEN1 (0.54) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL26777737 0.68 CUL4A (0.36) MEN1KMT2ACUL4AALDH1A1MAPT
SCHEMBL4499976 0.67 KMT2A (0.51) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL4488936 0.67 MAPT (0.50) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL4485871 0.67 CCR2 (0.38) MEN1KMT2ACUL4AALDH1A1MAPT
SCHEMBL5141049 0.66 GAA (0.43) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL12638578 0.65 CYP2C9 (0.37) MEN1KMT2AALDH1A1KDM4ECYP2C9
Potassium Ion SCHEMBL4511656 0.65 CUL4A (0.50) MEN1KMT2ACUL4AALDH1A1MAPT
SCHEMBL4482499 0.64 ALDH1A1 (0.43) MEN1KMT2AALDH1A1MAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 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-20050282850-A1 Heterotricylic compounds for use as HCV inhibitors HAVCR2, PYGL, HCCS F12 1686/4885MEN1 4682/4885KMT2A 4422/4885

“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.