SCHEMBL5067436

SCHEMBL5067436

Cc1ccccc1COc1cc(-n2cnc3ccccc32)sc1C(=O)N(C)C

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 19/20 0.80
NEK2 P51955 2/20 0.60
MAP4K4 O95819 1/20 0.60
CSF1R P07333 1/20 0.60
PIM1 P11309 1/20 0.60
KDR P35968 1/20 0.60
LIMK1 P53667 1/20 0.60
STK3 Q13188 1/20 0.60
CAMK2B Q13554 1/20 0.60
CAMK2G Q13555 1/20 0.60
CAMK2D Q13557 1/20 0.60
DYRK1A Q13627 1/20 0.60
CAMK1 Q14012 1/20 0.60
PKN2 Q16513 1/20 0.60
HIPK4 Q8NE63 1/20 0.60
BRSK1 Q8TDC3 1/20 0.60
AURKB Q96GD4 1/20 0.60
SLK Q9H2G2 1/20 0.60
PLK3 Q9H4B4 1/20 0.60
CLK4 Q9HAZ1 1/20 0.60

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
SCHEMBL5063355 0.91 PLK1 (0.85) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5062604 0.90 PLK1 (0.83) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL4041917 0.89 PLK1 (1.00) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5066012 0.88 PLK1 (0.80) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5062512 0.87 PLK1 (0.79) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5062584 0.86 PLK1 (0.76) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5063317 0.86 PLK1 (0.76) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5062297 0.84 PLK1 (0.74) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5062593 0.83 PLK1 (0.73) PLK1NEK2MAP4K4CSF1RPIM1
SCHEMBL5062409 0.82 PLK1 (0.78) PLK1NEK2MAP4K4CSF1RPIM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7465807-B2 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION (US) 2008-12-16 US disclosed
US-7465807-B2 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION (US) 2008-12-16 US disclosed
US-20080269298-A1 Benzimidazol-1-YL-thiophene compounds for the treatment of cancer ANDREWS CLARENCE W 2008-10-30 US disclosed
US-20080269298-A1 Benzimidazol-1-YL-thiophene compounds for the treatment of cancer ANDREWS CLARENCE W 2008-10-30 US disclosed
US-20070060576-A1 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION 2007-03-15 US disclosed
US-20070060576-A1 Process for preparing benzimidazole thiophenes SMITHKLINE BEECHAM CORPORATION 2007-03-15 US disclosed
US-20060074119-A1 Thiophene compounds SMITHKLINE BEECHAM CORPORATION 2006-04-06 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 (3 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-20070060576-A1 Process for preparing benzimidazole thiophenes CYP3A4, TPMT, TYMP PLK1 193/4885NEK2 2846/4885MAP4K4 659/4885
US-20060074119-A1 Thiophene compounds TPMT, ABCB1, CYP3A5 PLK1 2123/4885NEK2 4031/4885MAP4K4 3124/4885
US-20080269298-A1 Benzimidazol-1-YL-thiophene compounds for the treatment of cancer ABCB1, TP53, CCNI PLK1 130/4885NEK2 636/4885MAP4K4 1754/4885

“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.