SCHEMBL4295258

SCHEMBL4295258

OCc1cc2ccncc2c2cc(Cl)ccc12

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
HTT P42858 2/20 0.41
POLB P06746 1/20 0.41
RAD52 P43351 1/20 0.41
HASPIN Q8TF76 1/20 0.40
CSNK2A1 P68400 3/20 0.39
CHUK O15111 1/20 0.39
HIPK2 Q9H2X6 3/20 0.38
NCOA3 Q9Y6Q9 1/20 0.38
MAPK1 P28482 1/20 0.35
GALR3 O60755 1/20 0.35
NR2F2 P24468 1/20 0.35
CSNK2A2 P19784 6/20 0.34
CSNK2B P67870 6/20 0.34
MAPT P10636 1/20 0.33
DYRK1A Q13627 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33

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
SCHEMBL13659553 0.82 KDM4E (0.59) KDM4EHTTPOLBRAD52HASPIN
SCHEMBL4296233 0.82 CHEK1 (0.47) KDM4EHTTPOLBRAD52HASPIN
SCHEMBL4290110 0.79 CHEK1 (0.52) KDM4EHTTPOLBRAD52CHUK
SCHEMBL4294298 0.75 KDM4E (0.51) KDM4EHTTCSNK2A1HIPK2CSNK2A2
SCHEMBL4298982 0.75 CHUK (0.49) KDM4EHTTPOLBRAD52CHUK
SCHEMBL4296237 0.73 CCNT1 (0.40) KDM4EHTTPOLBRAD52HASPIN
SCHEMBL4300946 0.73 NCOA3 (0.68) KDM4EHTTPOLBRAD52HASPIN
SCHEMBL29890089 0.72 HASPIN (0.45) KDM4EHTTPOLBRAD52HASPIN
SCHEMBL26933146 0.72 HASPIN (0.45) KDM4EHTTPOLBRAD52HASPIN
SCHEMBL4300956 0.71 CHEK1 (0.53) KDM4EHTTCSNK2A1HIPK2CSNK2A2

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-20090258852-A1 Inhibitors of Checkpoint Kinases MERCK SHARP & DOHME CORP. 2009-10-15 US disclosed
US-20090258852-A1 Inhibitors of Checkpoint Kinases MERCK SHARP & DOHME CORP. 2009-10-15 US disclosed
US-20090258852-A1 Inhibitors of Checkpoint Kinases MERCK SHARP & DOHME CORP. 2009-10-15 US disclosed
WO-2007008502-A2 INHIBITORS OF CHECKPOINT KINASES MERCK & CO., INC. (US) 2007-01-18 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-20090258852-A1 Inhibitors of Checkpoint Kinases CHEK1, CHEK2, CDKN1A KDM4E 366/4885HTT 3947/4885POLB 841/4885

“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.