SCHEMBL13221237

SCHEMBL13221237

O=C(Nc1ccc(Sc2cc3nccn3c(Nc3cc(C4CC4)[nH]n3)n2)cc1)c1ccncc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 2/20 0.44
▸ GSK3B P49841 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ IGF1R P08069 9/20 0.43
▸ CCNA2 P20248 6/20 0.43
▸ CDK2 P24941 6/20 0.43
▸ CCNA1 P78396 6/20 0.43
▸ HPGDS O60760 1/20 0.39
▸ CRACR2A Q9BSW2 1/20 0.39

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
SCHEMBL13221232 0.91 SRC (0.44) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13221250 0.89 CCNA2 (0.44) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13220983 0.88 AURKB (0.46) SRCGSK3BAURKBIGF1RCDK2
SCHEMBL13221282 0.87 IGF1R (0.51) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13221197 0.86 SRC (0.44) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13221227 0.86 AURKB (0.44) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13221235 0.86 SRC (0.44) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13221234 0.86 SRC (0.44) SRCGSK3BAURKBIGF1RCDK2
SCHEMBL13221280 0.86 IGF1R (0.45) SRCGSK3BAURKBIGF1RCCNA2
SCHEMBL13221288 0.86 CCNA2 (0.44) SRCGSK3BAURKBIGF1RCCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 — — US disclosed
US-8288536-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-10-16 — — US disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 — — US disclosed
US-20100216765-A1 KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-08-26 — — US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 — — US disclosed
US-7713973-B2 Kinase inhibitors TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-05-11 — — 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-20100216765-A1 KINASE INHIBITORS MAP3K20, MAP3K19, MAP3K1 SRC 63/4885GSK3B 200/4885AURKB 122/4885

“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.

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