SCHEMBL3864320

SCHEMBL3864320

O=[N+]([O-])c1ccc(Nc2nccc(-c3cccnc3)n2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 6/20 0.76
PRKCA P17252 5/20 0.76
BCR P11274 5/20 0.76
EGFR P00533 3/20 0.76
SRC P12931 2/20 0.76
PLK1 P53350 1/20 0.76
PIK3CA P42336 5/20 0.70
PIK3CB P42338 5/20 0.70
PIK3CG P48736 5/20 0.70
PRKCD Q05655 2/20 0.69
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
CDK2 P24941 2/20 0.62
CDK4 P11802 1/20 0.62
GSK3B P49841 1/20 0.62
ABCG2 Q9UNQ0 2/20 0.57
PRKACA P17612 1/20 0.57
PRKACG P22612 1/20 0.57
PRKACB P22694 1/20 0.57
IKBKB O14920 1/20 0.55

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
SCHEMBL1977 0.86 ABL1 (1.00) ABL1PRKCABCREGFRSRC
SCHEMBL4735604 0.86 PLK1 (1.00) ABL1PRKCABCREGFRSRC
SCHEMBL8246547 0.85 ABL1 (0.58) ABL1PRKCABCREGFRSRC
SCHEMBL28983303 0.83 ABL1 (0.71) ABL1PRKCABCREGFRSRC
SCHEMBL2009 0.83 ABL1 (0.74) ABL1PRKCABCREGFRSRC
SCHEMBL4734426 0.83 PLK1 (0.80) ABL1PRKCABCREGFRSRC
SCHEMBL29364396 0.83 ABL1 (0.69) ABL1PRKCABCREGFRSRC
SCHEMBL1550 0.83 ABL1 (0.69) ABL1PRKCABCREGFRSRC
SCHEMBL3861941 0.83 ABL1 (0.69) ABL1PRKCABCREGFRSRC
SCHEMBL6262145 0.82 ABL1 (1.00) ABL1PRKCABCREGFRSRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7595323-B2 N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof IL YANG PHARM. CO., LTD. (KR) 2009-09-29 US disclosed
US-7595323-B2 N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof IL YANG PHARM. CO., LTD. (KR) 2009-09-29 US disclosed
US-20040248918-A1 Anticancer agents IL YANG PHARM. CO., LTD. 2004-12-09 US disclosed
WO-2004099186-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL YANG PHARM CO., LTD. (KR) 2004-11-18 WO disclosed
WO-2004099187-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL YANG PHARM. CO. LTD. (KR) 2004-11-18 WO 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-20040248918-A1 Anticancer agents BRDT, CHIA, RNASE1 ABL1 1106/4885PRKCA 2433/4885BCR 2730/4885

“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.