SCHEMBL5582072

SCHEMBL5582072

CCOC(=O)C=Cc1cc(-c2cncc(Cl)c2)c2cnc(N(CC)CC)nc2c1OC

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CCNC P24863 5/20 0.37
CDK8 P49336 5/20 0.37
CDK19 Q9BWU1 1/20 0.37
DPP4 P27487 1/20 0.35
XPO1 O14980 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
P2RY12 Q9H244 1/20 0.32
P2RX3 P56373 3/20 0.32
FDPS P14324 1/20 0.32
TP53 P04637 1/20 0.31
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
BCHE P06276 2/20 0.31
ACHE P22303 2/20 0.31
PDE4B Q07343 1/20 0.31
ESR1 P03372 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
SCHEMBL5582069 1.00 CCNC (0.37) CCNCCDK8CDK19DPP4XPO1
SCHEMBL5581764 0.91 TDP1 (0.36) TDP1TP53MAPTSMN1; SMN2
SCHEMBL5581758 0.91 TDP1 (0.36) TDP1TP53MAPTSMN1; SMN2
SCHEMBL5582041 0.81 DPP4 (0.33) DPP4TDP1
SCHEMBL5582261 0.81 CCNC (0.42) CCNCCDK8CDK19DPP4MAPT
SCHEMBL5582264 0.81 CCNC (0.42) CCNCCDK8CDK19DPP4MAPT
SCHEMBL5581855 0.79 RXFP1 (0.33) TDP1
SCHEMBL5581670 0.78 PTGES (0.38) TDP1
SCHEMBL5581769 0.78 TDP1 (0.36) TDP1
SCHEMBL5582145 0.78 CCNC (0.42) CCNCCDK8CDK19DPP4MAPT

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 CCNC 3850/4885CDK8 2250/4885CDK19 2627/4885

“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.