SCHEMBL32664703

SCHEMBL32664703

COc1ccc(CN(Cc2ccc(OC)cc2)c2nccc3c2[nH]c(=O)n3[C@@H]2CN(C(=O)OC(C)(C)C)CC(F)(F)C2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BACE1 P56817 2/20 0.36
▸ CTSD P07339 1/20 0.36
▸ CTSE P14091 1/20 0.36
▸ SLC2A1 P11166 1/20 0.35
▸ HRH1 P35367 1/20 0.33
▸ HRH4 Q9H3N8 1/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ CCR5 P51681 1/20 0.32
▸ PIK3CA P42336 1/20 0.32
▸ MTOR P42345 1/20 0.32
▸ PRKDC P78527 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ JAK1 P23458 1/20 0.32
▸ BTK Q06187 2/20 0.32
▸ CCNT1 O60563 2/20 0.32
▸ CDK9 P50750 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ PARP1 P09874 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ SCN5A Q14524 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
SCHEMBL31279119 1.00 BACE1 (0.36) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL31279004 0.92 SLC2A1 (0.35) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL32664570 0.92 SLC2A1 (0.35) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL29737046 0.86 SLC2A1 (0.36) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL18289976 0.86 HTR6 (0.40) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL30111801 0.86 HTR6 (0.40) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL32664297 0.85 SLC2A1 (0.35) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL31280171 0.85 SLC2A1 (0.35) BACE1CTSDCTSESLC2A1HRH1
SCHEMBL31278495 0.82 BTK (0.46) BTK
SCHEMBL32664459 0.82 BTK (0.46) BTK

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-20260022123-A1 Methods of Making Modified BTK Inhibitors PRINCIPIA BIOPHARMA INC. (US) 2026-01-22 — — 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-20260022123-A1 Methods of Making Modified BTK Inhibitors BTK, TEC, SYK BACE1 3539/4885CTSD 1035/4885CTSE 1008/4885

“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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