SCHEMBL3858318

SCHEMBL3858318

O=C(Nc1cccc(Nc2nccc(-c3cccnc3)n2)c1)c1ccc(CN2CCCCC2)cc1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 18/20 0.84
BCR P11274 17/20 0.84
PDGFRA P16234 10/20 0.84
PDGFRB P09619 7/20 0.84
SRC P12931 6/20 0.84
SYK P43405 2/20 0.84
PRKCA P17252 4/20 0.69
PRKCD Q05655 3/20 0.69
PRKD3 O94806 1/20 0.69
PRKCG P05129 1/20 0.69
PRKCB P05771 1/20 0.69
PRKCH P24723 1/20 0.69
PRKCI P41743 1/20 0.69
PRKCE Q02156 1/20 0.69
PRKCQ Q04759 1/20 0.69
PRKCZ Q05513 1/20 0.69
PRKD1 Q15139 1/20 0.69
KIT P10721 7/20 0.69
ABL2 P42684 2/20 0.69
PLK4 O00444 1/20 0.69

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
SCHEMBL3864378 0.96 ABL1 (0.81) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL2992321 0.93 ABL1 (0.73) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL3866664 0.92 ABL1 (0.94) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL26358567 0.92 ABL1 (0.85) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL13038805 0.92 ABL1 (0.82) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL9485 0.92 ABL1 (1.00) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL3867814 0.89 ABL1 (0.88) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL16802310 0.89 ABL1 (0.68) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL2990662 0.89 ABL1 (0.70) ABL1BCRPDGFRAPDGFRBSRC
SCHEMBL8261009 0.89 ABL1 (0.94) ABL1BCRPDGFRAPDGFRBSRC

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 4 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-20040248918-A1 Anticancer agents IL YANG PHARM. CO., LTD. 2004-12-09 US 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
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

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 1106/4885BCR 2730/4885PDGFRA 239/4885

“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.