SCHEMBL4996165

SCHEMBL4996165

O=C(O)c1cc(F)ccc1-c1nccc(-c2cc3n(n2)CCNC3=O)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.44
HCRTR1 O43613 14/20 0.39
HCRTR2 O43614 14/20 0.39
KMO O15229 1/20 0.38
PIM1 P11309 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
KDM4A O75164 1/20 0.34
KDM5A P29375 1/20 0.34
KDM4C Q9H3R0 1/20 0.34
KDM5B Q9UGL1 1/20 0.34
CCNT1 O60563 1/20 0.33
CDK9 P50750 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
SCHEMBL4994749 0.87 CDC7 (0.46) CDC7PIM1PIM2KDM4C
SCHEMBL4996436 0.86 CDC7 (0.48) CDC7KMOPIM1PIM2KDM4A
SCHEMBL4990948 0.85 SMN1; SMN2 (0.42) CDC7PIM1PIM2KDM5AKDM4C
SCHEMBL5000343 0.85 CDC7 (0.45) CDC7KMOPIM1PIM2KDM4A
SCHEMBL14188687 0.85 CDC7 (0.46) CDC7PIM1PIM2CDK9
SCHEMBL14188615 0.85 CDC7 (0.46) CDC7KMOPIM1PIM2
SCHEMBL14188482 0.85 CDC7 (0.46) CDC7PIM1PIM2
SCHEMBL5002969 0.84 CDC7 (0.48) CDC7KMOPIM1PIM2
SCHEMBL14188512 0.83 CDC7 (0.47) CDC7PIM1PIM2
SCHEMBL4997417 0.83 CDC7 (0.45) CDC7PIM1PIM2

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-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS HANAU CATHLEEN E 2008-05-15 US disclosed
US-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS HANAU CATHLEEN E 2008-05-15 US disclosed
US-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS HANAU CATHLEEN E 2008-05-15 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-20080113971-A1 PYRAZOLE COMPOUNDS AS PROTEIN KINASE INHIBITORS MKNK2, MAPKAPK2, MAP3K2 CDC7 487/4885HCRTR1 4452/4885HCRTR2 2254/4885

“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.