SCHEMBL209261

SCHEMBL209261

O=C(O)N1CCN(Cc2ccc(-c3nc4c(N5CCN(Cc6cncnc6)CC5)c(Cl)cnc4[nH]3)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AURKA O14965 14/20 0.47
FLT3 P36888 2/20 0.45
AURKB Q96GD4 2/20 0.40
KDR P35968 1/20 0.40
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
PARP1 P09874 3/20 0.38
DGAT1 O75907 2/20 0.38
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL209864 0.88 TBK1 (0.44) AURKAFLT3
SCHEMBL210868 0.87 AURKA (0.50) AURKAFLT3AURKBCYP2D6CYP2C9
SCHEMBL211129 0.87 AURKA (0.48) AURKAAURKBKDRCYP2D6CYP2C9
SCHEMBL207979 0.84 AURKA (0.43) AURKAFLT3AURKBCYP2D6CYP2C9
SCHEMBL209965 0.84 AURKA (0.62) AURKAFLT3
SCHEMBL4754664 0.83 AURKA (0.56) AURKAAURKBKDR
SCHEMBL212793 0.81 AURKA (0.59) AURKAAURKBKDRCYP2D6CYP2C9
SCHEMBL4756520 0.81 AURKA (0.48) AURKAAURKBKDRCYP2D6CYP2C9
SCHEMBL4789483 0.80 AURKA (0.55) AURKAFLT3DGAT1
SCHEMBL13985474 0.78 AURKA (0.52) AURKAAURKBKDRCYP2D6CYP2C9

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-1963315-B1 ENZYME INHIBITORS CANCER REC TECH LTD (GB) 2014-10-08 EP disclosed
US-8088761-B2 Enzyme inhibitors CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2012-01-03 US disclosed
US-20090247507-A1 Enzyme Inhibitors THE INSTITUTE OF CANCER RESEARCH (GB) 2009-10-01 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-20090247507-A1 Enzyme Inhibitors AURKC, AURKB, AURKA AURKA 3/4885FLT3 205/4885AURKB 2/4885

“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.