SCHEMBL29970820

SCHEMBL29970820

Cn1cc2c(Cl)c(-c3cn(COCC[Si](C)(C)C)c4nc(N5CC[C@H](NC(=O)OC(C)(C)C)[C@H](F)C5)cnc34)ccc2n1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PTPN11 Q06124 13/20 0.46
▸ MAP4K4 O95819 2/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ RET P07949 4/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ BTK Q06187 1/20 0.35

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
SCHEMBL29970903 1.00 PTPN11 (0.46) PTPN11MAP4K4KCNH2RETJAK3
SCHEMBL29970892 1.00 PTPN11 (0.46) PTPN11MAP4K4KCNH2RETJAK3
SCHEMBL29969800 0.93 PTPN11 (0.47) PTPN11MAP4K4KCNH2RET
SCHEMBL23208806 0.92 PTPN11 (0.51) PTPN11KCNH2
SCHEMBL23208873 0.92 PTPN11 (0.51) PTPN11KCNH2
SCHEMBL23209070 0.92 PTPN11 (0.51) PTPN11KCNH2
SCHEMBL29971230 0.91 PTPN11 (0.47) PTPN11MAP4K4KCNH2JAK3BTK
SCHEMBL29970003 0.90 PTPN11 (0.46) PTPN11MAP4K4RETJAK3BTK
SCHEMBL23229440 0.90 PTPN11 (0.46) PTPN11MAP4K4RETJAK3BTK
SCHEMBL23229367 0.89 PTPN11 (0.48) PTPN11MAP4K4RETJAK3BTK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11466016-B2 Pharmaceutical compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2022-10-11 — — 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-11466016-B2 Pharmaceutical compounds MAPT, CYP3A5, SLC5A1 PTPN11 326/4885MAP4K4 782/4885KCNH2 1395/4885

“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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