SCHEMBL5582159

SCHEMBL5582159

CCN(CC)c1ncc2c(-c3cncc(Cl)c3)cc(-c3ccc(C(=O)O)cc3)c(OC)c2n1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
RARB P10826 4/20 0.35
RARG P13631 4/20 0.35
CHEK1 O14757 1/20 0.35
CSNK2A2 P19784 2/20 0.35
CSNK2B P67870 2/20 0.35
MKNK1 Q9BUB5 1/20 0.34
MKNK2 Q9HBH9 1/20 0.34
RARA P10276 3/20 0.34
MAP4K4 O95819 2/20 0.34
NEK2 P51955 1/20 0.34
MDM2 Q00987 1/20 0.33
ADH5 P11766 1/20 0.33

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
SCHEMBL5581741 0.91 EIF4EBP1 (0.39) TDP1
SCHEMBL5581713 0.83 CSNK2A1 (0.42) CHEK1CSNK2A2CSNK2BMKNK1MKNK2
SCHEMBL5581670 0.81 PTGES (0.38) TDP1
SCHEMBL5581758 0.81 TDP1 (0.36) TDP1
SCHEMBL5581769 0.81 TDP1 (0.36) TDP1
SCHEMBL5581764 0.81 TDP1 (0.36) TDP1
SCHEMBL5581855 0.80 RXFP1 (0.33) TDP1
SCHEMBL5581974 0.79 MAP4K4 (0.45) CSNK2A2CSNK2BMAP4K4NEK2
SCHEMBL5582041 0.78 DPP4 (0.33) TDP1
SCHEMBL5582072 0.78 CCNC (0.37) TDP1

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 TDP1 2572/4885RARB 2741/4885RARG 3251/4885

“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.