SCHEMBL19260352

SCHEMBL19260352

Cc1cc(F)cc(F)c1.F[B-](F)(F)F.F[B-](F)(F)F.F[B-](F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 4/20 0.44
ACHE P22303 3/20 0.43
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
PTGS1 P23219 1/20 0.34
PTGS2 P35354 1/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
APP P05067 1/20 0.32
BACE1 P56817 1/20 0.32
SELL P14151 1/20 0.30
SELP P16109 1/20 0.30
SELE P16581 1/20 0.30
HDAC3 O15379 1/20 0.30
HDAC1 Q13547 1/20 0.30
HDAC2 Q92769 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL91512 0.90
Ammonia Solution, Strong SCHEMBL28612638 0.87 RAPGEF4 (0.48) RAPGEF4ACHECA12CA1CA9
SCHEMBL12156 0.83
SCHEMBL20080910 0.78 RAPGEF4 (0.39) RAPGEF4ACHECA12CA1CA9
SCHEMBL1133443 0.73 RAPGEF4 (0.43) RAPGEF4ACHECA12CA1CA9
SCHEMBL19260368 0.73 ACHE (0.85) RAPGEF4ACHEALDH1A1TSHR
SCHEMBL13316887 0.71 ALDH1A1 (0.45) RAPGEF4ACHEALDH1A1TSHRCES2
SCHEMBL20811637 0.71 RAPGEF4 (0.38) RAPGEF4ACHECA12CA1CA9
SCHEMBL1438354 0.71
SCHEMBL3601402 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11548899-B2 Fused 1,4-oxazepines and related analogs as BET bromodomain inhibitors THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2023-01-10 US disclosed
US-20210188870-A1 FUSED 1,4-OXAZEPINES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS UNIV MICHIGAN REGENTS (US) 2021-06-24 US disclosed
EP-3416969-B1 FUSED 1,4-OXAZEPINES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS UNIV MICHIGAN REGENTS (US) 2021-05-05 EP disclosed
EP-3416969-A1 FUSED 1,4-OXAZEPINES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS The Regents of The University of Michigan (US) 2018-12-26 EP disclosed
WO-2017142881-A1 FUSED 1,4-OXAZEPINES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-08-24 WO 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-20210188870-A1 FUSED 1,4-OXAZEPINES AND RELATED ANALOGS AS BET BROMODOMAIN INHIBITORS BRD4, BRD3, BRD2 RAPGEF4 2453/4885ACHE 2781/4885CA12 3259/4885
US-11548899-B2 Fused 1,4-oxazepines and related analogs as BET bromodomain inhibitors BRD4, BRD3, BRD2 RAPGEF4 2453/4885ACHE 2781/4885CA12 3259/4885

“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.