SCHEMBL4994491

SCHEMBL4994491

O=C(O)c1ccccc1C(=O)Nc1cccc(-c2nccc(-c3cc4n(n3)CCNC4=O)n2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 2/20 0.47
BCR P11274 2/20 0.47
SRC P12931 2/20 0.47
SMO Q99835 2/20 0.43
CDC7 O00311 1/20 0.41
RPS6KA2 Q15349 5/20 0.40
HTT P42858 1/20 0.39
RPS6KA3 P51812 4/20 0.39
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 3/20 0.39
KMT2A Q03164 3/20 0.39
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
PRKD3 O94806 1/20 0.37
PRKCG P05129 1/20 0.37
PRKCB P05771 1/20 0.37
PDGFRB P09619 1/20 0.37
PDGFRA P16234 1/20 0.37
PRKCA P17252 1/20 0.37
PRKCH P24723 1/20 0.37

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
SCHEMBL4994840 0.91 SMO (0.52) ABL1BCRSRCSMOCDC7
SCHEMBL4996328 0.86 FYN (0.46) CDC7MEN1ALDH1A1KMT2A
SCHEMBL4997440 0.82 CDC7 (0.49) ABL1BCRCDC7PRKCA
SCHEMBL4991294 0.81 CDC7 (0.52) CDC7MEN1KMT2A
SCHEMBL4990601 0.81 CDC7 (0.56) SMOCDC7MEN1KMT2A
SCHEMBL5002475 0.81 CDC7 (0.47) CDC7RPS6KA2MEN1KMT2A
SCHEMBL4994749 0.80 CDC7 (0.46) CDC7RPS6KA2RPS6KA3
SCHEMBL4991016 0.79 CDC7 (0.54) SMOCDC7MEN1KMT2A
SCHEMBL4991274 0.78 CDC7 (0.51) CDC7
SCHEMBL4994895 0.78 CDC7 (0.56) SMOCDC7MEN1KMT2A

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 ABL1 563/4885BCR 3771/4885SRC 548/4885

“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.