SCHEMBL13221283

SCHEMBL13221283

O=C(c1ccc(Sc2cc3nccn3c(Nc3cc(C4CC4)[nH]n3)n2)cc1)N1CCC1

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 7/20 0.45
▸ PAK1 Q13153 5/20 0.39
▸ PAK4 O96013 4/20 0.39
▸ SRC P12931 1/20 0.38
▸ GSK3B P49841 1/20 0.38
▸ AURKB Q96GD4 1/20 0.38
▸ CCNA2 P20248 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ CCNA1 P78396 1/20 0.38
▸ PIK3C3 Q8NEB9 1/20 0.37
▸ STK25 O00506 1/20 0.37
▸ PAK5 Q9P286 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
SCHEMBL13221281 0.94 PAK4 (0.46) IGF1RPAK1PAK4SRCGSK3B
SCHEMBL13221290 0.93 IGF1R (0.44) IGF1RPAK1PAK4SRCGSK3B
SCHEMBL13221235 0.87 SRC (0.44) IGF1RSRCGSK3BAURKBCCNA2
SCHEMBL13221282 0.87 IGF1R (0.51) IGF1RPAK1SRCGSK3BAURKB
SCHEMBL13221288 0.85 CCNA2 (0.44) IGF1RPAK1SRCGSK3BAURKB
SCHEMBL13221280 0.85 IGF1R (0.45) IGF1RPAK1SRCGSK3BAURKB
SCHEMBL13221297 0.85 IGF1R (0.43) IGF1RPAK1SRCGSK3BAURKB
SCHEMBL13221285 0.84 IGF1R (0.49) IGF1RPAK1PAK4SRCGSK3B
SCHEMBL13221237 0.84 SRC (0.44) IGF1RSRCGSK3BAURKBCCNA2
SCHEMBL13221303 0.84 IGF1R (0.47) IGF1RPAK1CCNA2CDK2CCNA1

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 IGF1R 787/4885PAK1 207/4885PAK4 195/4885

“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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