SCHEMBL13221049

SCHEMBL13221049

COc1cc(-c2cc3nccn3c(Nc3cc(C4CC4)[nH]n3)n2)ccn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 4/20 0.44
▸ SYK P43405 5/20 0.43
▸ PAK1 Q13153 2/20 0.43
▸ MAP4K2 Q12851 3/20 0.41
▸ MAP4K4 O95819 2/20 0.41
▸ PKN2 Q16513 2/20 0.41
▸ AURKB Q96GD4 2/20 0.41
▸ SLK Q9H2G2 2/20 0.41
▸ AURKA O14965 1/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ INSR P06213 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ LYN P07948 1/20 0.41
▸ RET P07949 1/20 0.41
▸ ROS1 P08922 1/20 0.41
▸ SRC P12931 1/20 0.41
▸ FER P16591 1/20 0.41
▸ KDR P35968 1/20 0.41
▸ BLK P51451 1/20 0.41
▸ RPS6KA3 P51812 1/20 0.41

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
SCHEMBL13221032 0.88 IGF1R (0.52) IGF1RSYKPAK1MAP4K2MAP4K4
SCHEMBL13221042 0.87 SYK (0.58) IGF1RSYKPAK1MAP4K2MAP4K4
SCHEMBL13221031 0.87 PAK1 (0.44) IGF1RSYKPAK1PAK4NEK1
SCHEMBL13221035 0.86 IGF1R (0.51) IGF1RSYKPAK1MAP4K2MAP4K4
SCHEMBL13221092 0.85 CCNA2 (0.44) IGF1RPAK1MAP4K2CDK2NEK1
SCHEMBL13221028 0.85 IGF1R (0.45) IGF1RSYKPAK1PAK4NEK1
SCHEMBL13220997 0.85 NEK1 (0.49) IGF1RPAK1NEK1
SCHEMBL13221056 0.83 NEK1 (0.47) IGF1RPAK1CDK2NEK1
SCHEMBL13221048 0.83 IGF1R (0.45) IGF1RSYKPAK1MAP4K2MAP4K4
SCHEMBL13221080 0.82 MAP4K2 (0.47) IGF1RSYKMAP4K2MAP4K4PKN2

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 787/4885SYK 395/4885PAK1 207/4885

“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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