SCHEMBL1007624

SCHEMBL1007624

NC(=O)c1nn2c(c1N)C(=O)NCC2

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.33
ALOX5 P09917 1/20 0.30
ALOX5AP P20292 1/20 0.30
FEN1 P39748 1/20 0.30
PARP1 P09874 1/20 0.30

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
SCHEMBL2572344 0.84 CDC7 (0.33) CDC7ALOX5ALOX5APFEN1PARP1
SCHEMBL29544632 0.76 CDC7 (0.36) CDC7
SCHEMBL20662112 0.76 CDC7 (0.36) CDC7ALOX5ALOX5APFEN1PARP1
Hydrochloric Acid SCHEMBL18209645 0.74 ALOX5 (0.35) CDC7ALOX5ALOX5APFEN1PARP1
SCHEMBL18632622 0.73 CDC7 (0.34) CDC7ALOX5ALOX5APFEN1PARP1
SCHEMBL9938070 0.72 CDC7 (0.33) CDC7ALOX5ALOX5APFEN1
SCHEMBL18655523 0.72 CDC7 (0.33) CDC7ALOX5ALOX5APFEN1PARP1
SCHEMBL1007694 0.72 ADORA2A (0.31)
SCHEMBL18655531 0.72 ALOX5 (0.34) CDC7ALOX5ALOX5APFEN1PARP1
SCHEMBL6386717 0.70 GAA (0.34)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118236-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-05-19 US disclosed
EP-2269990-A1 HETEROCYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-01-05 EP 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-20110118236-A1 HETEROCYCLIC COMPOUND GRIN1, GRM1, GRIK1 CDC7 3270/4885ALOX5 3983/4885ALOX5AP 3977/4885

“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.