SCHEMBL3947629

SCHEMBL3947629

CCOC(=O)c1ccc(Nc2nccc(-c3cccnc3)n2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 12/20 0.62
BCR P11274 9/20 0.62
SRC P12931 1/20 0.62
KDM4E B2RXH2 1/20 0.61
CYP1A2 P05177 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2D6 P10635 1/20 0.61
MAPT P10636 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61
NPSR1 Q6W5P4 1/20 0.61
PRKCA P17252 4/20 0.60
EGFR P00533 2/20 0.60
PRKCD Q05655 1/20 0.60
PDGFRA P16234 8/20 0.58
PDGFRB P09619 5/20 0.58
HDAC1 Q13547 1/20 0.58
ACVR1 Q04771 1/20 0.55
MEN1 O00255 1/20 0.55
THRB P10828 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
SCHEMBL1927060 0.88 ABL1 (0.80) ABL1BCRSRCKDM4EMAPT
SCHEMBL1908559 0.86 ABL1 (0.65) ABL1BCRSRCPRKCAEGFR
SCHEMBL23897367 0.86 MEN1 (0.57) ABL1BCRKDM4EMAPTPDGFRA
SCHEMBL3946636 0.85 RAB9A (0.57) ABL1BCRSRCKDM4ECYP1A2
SCHEMBL2861035 0.84 MEN1 (0.55) MAPTMEN1THRBRAB9AKMT2A
SCHEMBL4071652 0.84 MAPK8 (0.67) MAPTACVR1MEN1THRBRAB9A
SCHEMBL7467179 0.83 ABL1 (0.69) ABL1BCRSRCPRKCAEGFR
SCHEMBL15976954 0.83 MAPT (0.63) KDM4ECYP1A2CYP3A4CYP2D6MAPT
Hydrochloric Acid SCHEMBL15966808 0.83 MAPT (0.62) KDM4ECYP1A2CYP3A4CYP2D6MAPT
SCHEMBL7475710 0.82 ABL1 (0.71) ABL1BCRSRCPRKCAEGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1922309-B1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL YANG PHARM CO LTD (KR) 2014-05-21 EP disclosed
US-7501424-B2 N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof IL-YANG PHARM. CO., LTD. (KR) 2009-03-10 US disclosed
EP-1922309-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Il Yang Pharm. Co. Ltd. (KR) 2008-05-21 EP disclosed
US-20080096899-A1 N-Phenyl-2-Pyrimidine-Amine Derivatives and Process for the Preparation Thereof IL-YANG PHARM. CO., LTD. (KR) 2008-04-24 US disclosed
CN-101155786-A N-phenyl-2-pyrimidine-amine derivatives and process for the preparation thereof IL YANG PHARM CO LTD (KR) 2008-04-02 CN disclosed
WO-2007018325-A1 N-PHENYL-2-PYRIMIDINE-AMINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF IL-YANG PHARM. CO., LTD. (KR) 2007-02-15 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-20080096899-A1 N-Phenyl-2-Pyrimidine-Amine Derivatives and Process for the Preparation Thereof ITPA, TYMP, THPO ABL1 451/4885BCR 990/4885SRC 2852/4885

“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.