SCHEMBL21725695

SCHEMBL21725695

CC(C)(C)OC(=O)Nc1cccc(-n2c(N)nc3cc(CO[Si](C)(C)C(C)(C)C)ccc32)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACSS2 Q9NR19 1/20 0.39
▸ TEC P42680 4/20 0.38
▸ TXK P42681 3/20 0.38
▸ ITK Q08881 2/20 0.38
▸ TLR7 Q9NYK1 1/20 0.38
▸ ATM Q13315 1/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ SIRT2 Q8IXJ6 1/20 0.37
▸ F2RL3 Q96RI0 1/20 0.35
▸ TOP2A P11388 1/20 0.35
▸ TOP2B Q02880 1/20 0.35
▸ SYK P43405 1/20 0.35
▸ AURKA O14965 1/20 0.35
▸ RPS6KB1 P23443 1/20 0.35
▸ HDAC3 O15379 2/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC2 Q92769 1/20 0.34
▸ HDAC10 Q969S8 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ NCOR2 Q9Y618 1/20 0.34

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
SCHEMBL18687296 0.87 ACSS2 (0.42) ACSS2TECTXKITKTLR7
SCHEMBL22764122 0.83 TXK (0.49) ACSS2TECTXKITKATM
SCHEMBL18688111 0.83 TEC (0.58) TECTXKITK
SCHEMBL16767956 0.82 EGFR (0.45) ACSS2TLR7ATMBRD4SYK
SCHEMBL18687397 0.82 ITK (0.44) ACSS2TECTXKITKATM
SCHEMBL18687362 0.82 TEC (0.54) ACSS2TECTXKITKTLR7
SCHEMBL18687358 0.81 SIRT2 (0.46) ACSS2TLR7ATMBRD4SIRT2
SCHEMBL16755394 0.80 THRB (0.43) ACSS2ATMBRD4
SCHEMBL2031499 0.80 ALDH1A1 (0.42) SIRT2RPS6KB1
SCHEMBL18687507 0.80 TEC (0.60) TECTXKITK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200385369-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS GB005 INC (US) 2020-12-10 — — US disclosed
US-10562893-B2 Benzimidazoles derivatives as Tec kinases family inhibitors GB005, INC. (US) 2020-02-18 — — 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 (2 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-10562893-B2 Benzimidazoles derivatives as Tec kinases family inhibitors BMX, TEC, BTK ACSS2 3590/4885TEC 2/4885TXK 10/4885
US-20200385369-A1 NEW BENZIMIDAZOLES DERIVATIVES AS TEC KINASES FAMILY INHIBITORS BMX, TEC, BTK ACSS2 3481/4885TEC 2/4885TXK 9/4885

“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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