SCHEMBL1243564

SCHEMBL1243564

NCc1cccc(N(C(=O)C(F)(F)F)c2ccc(Nc3cc(-c4cccc5c4oc4ccccc45)ncn3)cc2)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 7/20 0.34
BCR P11274 6/20 0.34
MAPK1 P28482 3/20 0.34
KDM4E B2RXH2 2/20 0.34
MAPT P10636 2/20 0.34
CYP1A2 P05177 4/20 0.34
CYP2D6 P10635 4/20 0.34
CYP2C19 P33261 3/20 0.34
CYP3A4 P08684 2/20 0.34
HPGD P15428 2/20 0.34
CCNT1 O60563 5/20 0.34
CDK9 P50750 5/20 0.34
MAP4K4 O95819 1/20 0.34
CDK1 P06493 1/20 0.34
CDK4 P11802 1/20 0.34
CCNB1 P14635 1/20 0.34
CCNA2 P20248 1/20 0.34
CCND1 P24385 1/20 0.34
CDK2 P24941 1/20 0.34
ABL2 P42684 1/20 0.34

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
SCHEMBL1244315 0.95 ABL1 (0.36) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1242281 0.95 CCNT1 (0.37) KDM4EMAPTCYP1A2CYP2D6HPGD
SCHEMBL4384225 0.94 ABL1 (0.34) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1242005 0.90 ABL1 (0.35) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1244553 0.90 ABL1 (0.40) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1244804 0.90 ABL1 (0.34) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1244418 0.88 CCNT1 (0.34) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1244405 0.87 CYP1A2 (0.33) MAPK1MAPTCYP1A2CYP2D6CYP2C19
SCHEMBL1243618 0.87 CYP1A2 (0.36) ABL1BCRMAPK1KDM4EMAPT
SCHEMBL1242024 0.87 MEN1 (0.35) ABL1BCRMAPK1KDM4EMAPT

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
US-7879853-B2 tyrosisne kinase inhibitors such as N-[4-(6-Dibenzofuran-4-yl-pyrimidin-4-ylamino)-phenyl]-4-morpholin-4-yl-benzamide, used as anticasrcinogenic or antoproliferative agents, especially in the treatment of breast cancer BAYER SCHERING PHARMA AG (DE) 2011-02-01 US disclosed
EP-1763526-B1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS BAYER SCHERING PHARMA AG (DE) 2009-06-24 EP disclosed
US-20070208034-A1 4,6-disubstituted pyrimidines and their use as protein kinase inhibitors ATLANTA PHARMA AG (DE) 2007-09-06 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-20070208034-A1 4,6-disubstituted pyrimidines and their use as protein kinase inhibitors CDK2, DCK, DTYMK ABL1 55/4885BCR 844/4885MAPK1 61/4885

“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.