SCHEMBL3737526

SCHEMBL3737526

CCC(Oc1cc(-n2cnc3cnc(CO[Si](C)(C)C(C)(C)C)cc32)sc1C(=O)OC)c1ccccc1Cl

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 16/20 0.47
PLK3 Q9H4B4 14/20 0.47
IKBKE Q14164 2/20 0.47
CDK2 P24941 1/20 0.47
CYP2C9 P11712 2/20 0.41
CYP3A4 P08684 2/20 0.41
PIK3CD O00329 1/20 0.40
NUAK1 O60285 1/20 0.40
PDGFRB P09619 1/20 0.40
PIM1 P11309 1/20 0.40
KDR P35968 1/20 0.40
NEK2 P51955 1/20 0.40

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
SCHEMBL3741289 0.94 PLK1 (0.47) PLK1PLK3IKBKECDK2CYP2C9
SCHEMBL3736937 0.92 PLK1 (0.55) PLK1PLK3IKBKECDK2CYP2C9
SCHEMBL3734879 0.91 PLK1 (0.57) PLK1PLK3IKBKECDK2CYP2C9
SCHEMBL3734364 0.90 PLK1 (0.47) PLK1PLK3IKBKECDK2CYP2C9
SCHEMBL3734401 0.86 PLK1 (0.55) PLK1PLK3IKBKECDK2CYP2C9
SCHEMBL3736948 0.86 PLK1 (0.57) PLK1PLK3IKBKECDK2CYP2C9
SCHEMBL3737405 0.85 PLK1 (0.50) PLK1PLK3IKBKECDK2PIK3CD
SCHEMBL3734396 0.85 PLK1 (0.48) PLK1PLK3IKBKECDK2PIK3CD
SCHEMBL3737440 0.85 PLK1 (0.50) PLK1PLK3IKBKECDK2PIK3CD
SCHEMBL3729176 0.84 PLK1 (0.48) PLK1PLK3IKBKECDK2PIK3CD

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-8273890-B2 Thiophene-imidazopyridines 4SC AG (DE) 2012-09-25 US disclosed
US-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2010-11-04 US disclosed
WO-2009003911-A1 THIOPHENE-IMIDAZOPYRIDINES 4SC AG (DE) 2009-01-08 WO 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-20100278833-A1 THIOPHENE-IMIDAZOPYRIDINES PIKFYVE, PIP4K2B, PIP5K1B PLK1 642/4885PLK3 1528/4885IKBKE 1452/4885

“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.