SCHEMBL31213982

SCHEMBL31213982

C=CC(=O)Nc1ccc(-c2nn3ncnc(N)c3c2-c2ccc(OC3CCC(F)(F)CC3)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 18/20 0.38
▸ EGFR P00533 7/20 0.38
▸ KCNH2 Q12809 2/20 0.38
▸ HRH3 Q9Y5N1 1/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ ERBB2 P04626 1/20 0.35
▸ LCK P06239 1/20 0.35
▸ FYN P06241 1/20 0.35
▸ YES1 P07947 1/20 0.35
▸ LYN P07948 1/20 0.35
▸ HCK P08631 1/20 0.35
▸ FGR P09769 1/20 0.35
▸ SRC P12931 1/20 0.35
▸ FER P16591 1/20 0.35
▸ CSK P41240 1/20 0.35
▸ TEC P42680 1/20 0.35
▸ BLK P51451 1/20 0.35
▸ BMX P51813 1/20 0.35
▸ JAK3 P52333 1/20 0.35
▸ ITK Q08881 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
SCHEMBL31213879 0.95 BTK (0.37) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL30325769 0.93 BTK (0.42) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213870 0.92 BTK (0.38) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213849 0.91 BTK (0.42) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL30325744 0.91 BTK (0.41) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213919 0.90 BTK (0.42) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213888 0.89 BTK (0.39) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213986 0.89 BTK (0.44) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213877 0.88 BTK (0.39) BTKEGFRKCNH2ABL1ERBB2
SCHEMBL31213890 0.87 BTK (0.40) BTKEGFRKCNH2ABL1ERBB2

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-20240383905-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF 3H PHARMACEUTICALS CO., LTD. (CN) 2024-11-21 — — US claimed
US-20240383905-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF 3H PHARMACEUTICALS CO., LTD. (CN) 2024-11-21 — — 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-20240383905-A1 FGFR INHIBITORS AND METHODS OF USE THEREOF FGFR1, FGFR3, FGFR4 BTK 168/4885EGFR 45/4885KCNH2 4114/4885

“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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