SCHEMBL4114036

SCHEMBL4114036

COc1cc(C(=O)NC2CN(C)C2)ccc1Nc1ncc2c(n1)N(c1ccccc1)CCC(=O)N2C

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 2/20 0.68
PLK1 P53350 11/20 0.65
BRD4 O60885 12/20 0.61
DCLK1 O15075 3/20 0.61
LRRK2 Q5S007 3/20 0.61
MAPK7 Q13164 2/20 0.61
BRDT Q58F21 7/20 0.60
IGF1R P08069 1/20 0.55
ALK Q9UM73 1/20 0.55
PLK3 Q9H4B4 1/20 0.54

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
SCHEMBL1203122 0.93 RAD52 (0.77) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL3673701 0.91 RAD52 (0.62) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL3991428 0.88 RAD52 (0.62) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL4305075 0.88 BRD4 (0.60) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL12880456 0.88 PLK1 (0.66) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL1202878 0.88 PLK1 (0.73) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL12880454 0.87 PLK1 (0.74) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL1675790 0.86 PLK1 (0.66) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL1203721 0.86 PLK1 (0.75) RAD52PLK1BRD4DCLK1LRRK2
SCHEMBL1203680 0.86 PLK1 (0.65) RAD52PLK1BRD4DCLK1LRRK2

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-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US claimed
US-20090291938-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-26 US disclosed
WO-2009067547-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-05-28 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-20090291938-A1 POLO-LIKE KINASE INHIBITORS PLK1, PLK2, POLK RAD52 1250/4885PLK1 1/4885BRD4 1323/4885

“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.