SCHEMBL2250642

SCHEMBL2250642

Cc1cccc(COc2ccc(Nc3ncnc4ccc(NC(=O)CCN)cc34)cc2Cl)n1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 15/20 0.63
EGFR P00533 13/20 0.63
LCK P06239 1/20 0.63
ERBB4 Q15303 1/20 0.53
HDAC3 O15379 1/20 0.51
HDAC4 P56524 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
HDAC8 Q9BY41 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
GMPS P49915 1/20 0.51
ABL1 P00519 1/20 0.51
INSR P06213 1/20 0.51
PDGFRB P09619 1/20 0.51
CDK2 P24941 1/20 0.51

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
SCHEMBL2251408 0.88 ERBB2 (0.59) ERBB2EGFRLCKERBB4
SCHEMBL2249176 0.87 ERBB2 (0.79) ERBB2EGFRLCKERBB4AURKA
SCHEMBL4866309 0.85 EGFR (0.57) ERBB2EGFRLCKERBB4AURKA
SCHEMBL2249790 0.83 EGFR (0.83) ERBB2EGFRERBB4HDAC3HDAC4
SCHEMBL2250851 0.81 EGFR (0.62) ERBB2EGFRLCKERBB4HDAC3
SCHEMBL2251397 0.80 ERBB2 (0.79) ERBB2EGFRLCKERBB4AURKA
SCHEMBL2248477 0.80 EGFR (0.77) ERBB2EGFRERBB4HDAC3HDAC4
SCHEMBL2251932 0.79 EGFR (0.79) ERBB2EGFRERBB4HDAC3HDAC4
SCHEMBL4867987 0.79 EGFR (0.59) ERBB2EGFRLCKERBB4ABL1
SCHEMBL2249810 0.78 EGFR (0.78) ERBB2EGFRERBB4HDAC3HDAC4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1844022-B1 QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF HANMI SCIENCE CO LTD (KR) 2013-08-14 EP disclosed
US-8003658-B2 Quinazoline derivatives for inhibiting cancer cell growth and method for the preparation thereof HANMI HOLDINGS CO., LTD. (KR) 2011-08-23 US disclosed
US-20080009509-A1 Quinazoline Derivatives For Inhibiting Cancer Cell Growth And Method For The Preparation Thereof HANMI PHARM CO., LTD (KR) 2008-01-10 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-20080009509-A1 Quinazoline Derivatives For Inhibiting Cancer Cell Growth And Method For The Preparation Thereof MKI67, NQO2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ERBB2 1693/4885EGFR 1400/4885LCK 1194/4885

“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.