SCHEMBL19533288

SCHEMBL19533288

Cc1cn(C)c2c(=O)n(CC(F)(F)F)nc(N)c12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 1/20 0.33
▸ SYK P43405 1/20 0.33
▸ AURKB Q96GD4 1/20 0.33
▸ RET P07949 1/20 0.32

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
SCHEMBL19533296 0.82 PDE4A (0.41) —
SCHEMBL19533290 0.77 CDK8 (0.34) —
SCHEMBL19533707 0.77 PDE4A (0.42) AURKASYKAURKBRET
SCHEMBL19533297 0.70 ALOX15 (0.33) —
SCHEMBL19533293 0.64 JAK1 (0.36) —
SCHEMBL19533295 0.64 IDO1 (0.37) —
SCHEMBL18554801 0.62 ADORA2A (0.31) —
SCHEMBL15450891 0.62 KDM4E (0.31) —
SCHEMBL25756719 0.61 PDE5A (0.36) —
SCHEMBL23439990 0.61 P2RX7 (0.34) RET

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-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 (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-20170313683-A1 BTK INHIBITOR BTK, SYK, LYN AURKA 351/4885SYK 2/4885AURKB 230/4885

“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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