SCHEMBL4290168

SCHEMBL4290168

O=C(O)c1cc2cc[nH]c(=O)c2c2cc(-c3ccc(C(=O)N4CCOCC4)cc3)ccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.49
JAK2 O60674 3/20 0.48
ERN1 O75460 1/20 0.46
HPGD P15428 2/20 0.46
TAF1 P21675 2/20 0.45
GHSR Q92847 2/20 0.44
PLK4 O00444 1/20 0.43
MAP4K4 O95819 1/20 0.43
ROS1 P08922 1/20 0.43
FGFR1 P11362 1/20 0.43
FLT1 P17948 1/20 0.43
MARK3 P27448 1/20 0.43
FLT4 P35916 1/20 0.43
KDR P35968 1/20 0.43
FLT3 P36888 1/20 0.43
CLK2 P49760 1/20 0.43
CSNK1G2 P78368 1/20 0.43
MAP4K2 Q12851 1/20 0.43
ROCK1 Q13464 1/20 0.43
NTRK3 Q16288 1/20 0.43

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
SCHEMBL4297137 0.89 CHEK1 (0.56) CHEK1JAK2ERN1HPGDTAF1
SCHEMBL4294388 0.88 POLB (0.48) CHEK1JAK2TAF1GHSRBRD4
SCHEMBL4297281 0.80 ERN1 (0.47) CHEK1JAK2ERN1
SCHEMBL4295657 0.80 CHEK1 (0.52) CHEK1ERN1
SCHEMBL4288965 0.80 CHEK1 (0.50) CHEK1
SCHEMBL4291923 0.80 CHEK1 (0.50) CHEK1
SCHEMBL4298796 0.79 PIM1 (0.44) CHEK1FGFR1KDRFLT3ALDH1A1
SCHEMBL4289505 0.78 CHEK1 (0.57) CHEK1JAK2HPGDTAF1GHSR
SCHEMBL4295756 0.76 CHEK1 (0.51) CHEK1
SCHEMBL4289731 0.75 CHEK1 (0.64) CHEK1

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 1 patent. 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

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 CHEK1 1/4885JAK2 1085/4885ERN1 1611/4885

“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.