SCHEMBL19544868

SCHEMBL19544868

C=CC(=O)Nc1ccc2cnn(-c3nc(Nc4ccc(OCCOC)cc4)ncc3F)c2c1

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 15/20 0.66
▸ BTK Q06187 8/20 0.66
▸ ITK Q08881 8/20 0.66
▸ JAK2 O60674 1/20 0.66
▸ LYN P07948 1/20 0.66
▸ TEC P42680 1/20 0.66
▸ TXK P42681 1/20 0.66
▸ BMX P51813 1/20 0.66
▸ JAK3 P52333 1/20 0.66
▸ CD69 Q07108 1/20 0.66

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
SCHEMBL19544609 0.85 EGFR (0.57) EGFRBTKITKJAK2LYN
SCHEMBL19544576 0.85 EGFR (0.61) EGFRBTKITKJAK2LYN
SCHEMBL19544624 0.85 EGFR (0.65) EGFRBTKITKJAK2LYN
SCHEMBL19544867 0.83 SYK (0.48) EGFRBTKITKJAK2LYN
SCHEMBL19544866 0.81 EGFR (0.44) EGFRBTKITKJAK2LYN
Spebrutinib SCHEMBL626216 0.80 EGFR (1.00) EGFRBTKITKJAK2LYN
SCHEMBL29722399 0.80 EGFR (1.00) EGFRBTKITKJAK2LYN
SCHEMBL12518308 0.80 EGFR (1.00) EGFRBTKITKJAK2LYN
Spebrutinib SCHEMBL29359972 0.80 EGFR (1.00) EGFRBTKITKJAK2LYN
SCHEMBL19624412 0.80 EGFR (0.63) EGFRBTKITKJAK2LYN

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-10662174-B2 BTK inhibitor HUBEI BIO-PHARMACEUTICAL INDUSTRIAL TECHNOLOGICAL INSTITUTE, INC. (CN) 2020-05-26 — — US disclosed
US-20170313683-A1 BTK INHIBITOR HUBEI BIO-PHARMACEUTICAL INDUSTRIAL TECHNOLOGICAL INSTITUTE, INC. (CN) 2017-11-02 — — 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-10662174-B2 BTK inhibitor BTK, SYK, LYN EGFR 596/4885BTK 1/4885ITK 178/4885
US-20170313683-A1 BTK INHIBITOR BTK, SYK, LYN EGFR 596/4885BTK 1/4885ITK 178/4885

“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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