SCHEMBL5582246

SCHEMBL5582246

COc1c(Br)cc(-c2cccc(Cl)c2)c2cnc(NCC3CC3)nc12

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
STK4 Q13043 1/20 0.43
STK3 Q13188 1/20 0.43
VCP P55072 4/20 0.41
MAT2A P31153 1/20 0.39
PIM1 P11309 4/20 0.38
PIM2 Q9P1W9 2/20 0.38
ADORA1 P30542 6/20 0.38
PRKCQ Q04759 4/20 0.37

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
SCHEMBL5582009 0.88 ADORA1 (0.41) MAT2AADORA1
SCHEMBL5582140 0.86 ADORA1 (0.50) PIM1PIM2ADORA1
SCHEMBL5582126 0.85 PDE5A (0.43) ADORA1
SCHEMBL5582085 0.84 CSNK2A2 (0.38) ADORA1
SCHEMBL5582252 0.83 VCP (0.44) STK4STK3VCPADORA1
SCHEMBL5581817 0.82 CSNK2A2 (0.41) ADORA1
SCHEMBL5581989 0.78 DHFR (0.51) ADORA1
SCHEMBL5581717 0.78 TSHR (0.39) ADORA1
SCHEMBL5582020 0.77 ADORA1 (0.40) ADORA1
SCHEMBL5582200 0.76 MAPT (0.43) STK4STK3ADORA1

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 STK4 1193/4885STK3 1353/4885VCP 4804/4885

“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.