SCHEMBL4994308

SCHEMBL4994308

Cc1ccccc1-c1nccc(-c2cc3n(n2)CCNC3=O)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.49
PIM1 P11309 1/20 0.48
PIM2 Q9P1W9 1/20 0.48
CYP1A2 P05177 9/20 0.40
CYP3A4 P08684 7/20 0.40
CYP2C19 P33261 5/20 0.40
HSD17B10 Q99714 4/20 0.39
CYP2D6 P10635 4/20 0.39
ALOX15 P16050 3/20 0.39
TDP1 Q9NUW8 1/20 0.39
PARP1 P09874 6/20 0.38
ALDH1A1 P00352 4/20 0.38
TSHR P16473 3/20 0.38
CLK4 Q9HAZ1 3/20 0.38
HIF1A Q16665 2/20 0.38
TDP2 O95551 1/20 0.36
MAPK1 P28482 1/20 0.35
JAK2 O60674 1/20 0.35
GRM5 P41594 1/20 0.34
PARP10 Q53GL7 1/20 0.34

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
SCHEMBL4991101 0.91 PIM1 (0.48) CDC7PIM1PIM2PARP1MAPK1
SCHEMBL14188708 0.88 CDC7 (0.51) CDC7PIM1PIM2PARP1ALDH1A1
SCHEMBL4997342 0.88 CDC7 (0.48) CDC7PIM1PIM2PARP1GRM5
SCHEMBL4986910 0.88 CDC7 (0.48) CDC7PIM1PIM2PARP1ALDH1A1
SCHEMBL4996333 0.87 CDC7 (0.50) CDC7PIM1PIM2PARP1ALDH1A1
SCHEMBL5002764 0.87 CDC7 (0.48) CDC7PIM1PIM2PARP1GRM5
SCHEMBL5000396 0.87 CDC7 (0.47) CDC7PIM1PIM2CYP1A2CYP3A4
SCHEMBL5002646 0.86 CDC7 (0.49) CDC7PIM1PIM2CYP1A2PARP1
SCHEMBL4997121 0.86 CDC7 (0.49) CDC7PIM1PIM2HSD17B10TDP1
SCHEMBL4991826 0.86 CDC7 (0.49) CDC7PIM1PIM2PARP1

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 487/4885PIM1 539/4885PIM2 309/4885

“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.