SCHEMBL4397902

SCHEMBL4397902

C[C@@H](Oc1cc(-n2cnc3ccc(OS(=O)(=O)C(F)(F)F)cc32)sc1C(=O)O)c1ccccc1Cl

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 17/20 0.69
PLK3 Q9H4B4 15/20 0.69
PIK3CD O00329 1/20 0.60
NUAK1 O60285 1/20 0.60
PDGFRB P09619 1/20 0.60
PIM1 P11309 1/20 0.60
KDR P35968 1/20 0.60
NEK2 P51955 1/20 0.60
CDK2 P24941 1/20 0.59
IKBKE Q14164 1/20 0.59
CYP2C9 P11712 1/20 0.54

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
SCHEMBL4397857 0.93 PLK1 (0.69) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL2989078 0.91 PLK1 (0.74) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL4778201 0.86 PLK1 (0.71) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL5002846 0.86 PLK1 (0.71) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL2989134 0.85 PLK1 (0.70) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL4411691 0.85 PLK1 (0.83) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL4406226 0.85 PLK1 (0.84) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL2990389 0.84 PLK1 (0.73) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL5140937 0.84 PLK1 (0.73) PLK1PLK3PIK3CDNUAK1PDGFRB
SCHEMBL2989081 0.84 PLK1 (0.73) PLK1PLK3PIK3CDNUAK1PDGFRB

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
EP-1924572-B1 REGIOSELECTIVE PROCESS FOR PREPARING BENZIMIDAZOLE THIOPHENES SMITHKLINE BEECHAM CORP (US) 2009-12-30 EP disclosed
US-20080249301-A1 Regioselective Process for Preparing Benzimidazole Thiophenes SMITHKLINE BEECHAM CORPORATION 2008-10-09 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-20080249301-A1 Regioselective Process for Preparing Benzimidazole Thiophenes CYP3A4, CYP2C19, CYP2B6 PLK1 1718/4885PLK3 2097/4885PIK3CD 802/4885

“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.