SCHEMBL5582178

SCHEMBL5582178

COc1c(-c2ccc(C(=O)O)cc2)cc(-c2cccc(Cl)c2)c2cnc(NCc3ccccc3)nc12

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 3/20 0.45
CASR P41180 1/20 0.43
ADORA1 P30542 4/20 0.43
CSNK2A2 P19784 2/20 0.43
CSNK2B P67870 2/20 0.43
CSNK2A1 P68400 4/20 0.42
MAP4K4 O95819 1/20 0.42
ATM Q13315 2/20 0.41
PLA2G1B P04054 1/20 0.40
HTT P42858 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
VCP P55072 1/20 0.40

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
SCHEMBL5582205 0.91 CSNK2A2 (0.52) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5582212 0.89 CSNK2A1 (0.49) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5582252 0.88 VCP (0.44) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5582245 0.86 CSNK2A1 (0.51) CASRADORA1CSNK2A2CSNK2BCSNK2A1
SCHEMBL5582210 0.85 CSNK2A1 (0.51) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5582126 0.83 PDE5A (0.43) VNN1CASRADORA1HTT
SCHEMBL5582238 0.83 MAP4K4 (0.52) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5581995 0.82 CSNK2A1 (0.50) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5582194 0.82 CSNK2A1 (0.48) ADORA1CSNK2A2CSNK2BCSNK2A1MAP4K4
SCHEMBL5582330 0.82 CSNK2A1 (0.48) CSNK2A2CSNK2BCSNK2A1MAP4K4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070225308-A1 2-Amino Quinazoline Derivative KYOWA HAKKO KOGYO CO.,LTD. (JP) 2007-09-27 US disclosed
EP-1726584-A1 2-AMINOQUINAZOLINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-11-29 EP 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-20070225308-A1 2-Amino Quinazoline Derivative AGTR2, ABL1, AGTR1 VNN1 4521/4885CASR 1544/4885ADORA1 406/4885

“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.