SCHEMBL25294994

SCHEMBL25294994

CC(C)(C)OC(=O)N1CC(OCc2ccc(SC(F)(F)F)cc2)C1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 1/20 0.42
CRBN Q96SW2 1/20 0.42
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
PTPRZ1 P23471 2/20 0.41
GPR119 Q8TDV5 7/20 0.40
BACE1 P56817 2/20 0.40
BACE2 Q9Y5Z0 1/20 0.40
RORC P51449 1/20 0.39
EPHX2 P34913 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
NR1H2 P55055 1/20 0.38
NAMPT P43490 1/20 0.38
TACR1 P25103 2/20 0.37
USP30 Q70CQ3 1/20 0.36

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
SCHEMBL29496997 0.87 PRMT5 (0.41) PRMT5WDR77GPR119BACE1BACE2
SCHEMBL25297006 0.87 PRMT5 (0.41) PRMT5WDR77GPR119BACE1BACE2
SCHEMBL25295332 0.84 PTPRZ1 (0.46) PTPRZ1EPHX2NR1H4NAMPT
SCHEMBL16434872 0.84 BACE1 (0.49) DDB1CRBNPRMT5WDR77GPR119
SCHEMBL25326344 0.84 GPR119 (0.43) PRMT5WDR77GPR119RORCEPHX2
SCHEMBL18792536 0.83 GPR119 (0.48) DDB1CRBNPRMT5WDR77GPR119
SCHEMBL3123833 0.82 LIPE (0.52) DDB1CRBNPRMT5WDR77GPR119
SCHEMBL17274387 0.82 USP30 (0.47) DDB1CRBNPRMT5WDR77GPR119
SCHEMBL31043692 0.82 PRMT5 (0.44) DDB1CRBNPRMT5WDR77GPR119
SCHEMBL25295010 0.82 PRMT5 (0.44) DDB1CRBNPRMT5WDR77GPR119

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11981661-B2 Heterocyclic compounds HOFFMANN-LA ROCHE INC. (US) 2024-05-14 US disclosed
EP-4208456-A1 HETEROCYCLIC COMPOUNDS F. Hoffmann-La Roche AG (CH) 2023-07-12 EP disclosed
US-20220098176-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2022-03-31 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-20220098176-A1 HETEROCYCLIC COMPOUNDS CBR3, BRIX1, CCNY DDB1 2404/4885CRBN 570/4885PRMT5 949/4885
US-11981661-B2 Heterocyclic compounds CBR3, BRIX1, CCNY DDB1 2404/4885CRBN 570/4885PRMT5 949/4885

“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.