SCHEMBL29496997

SCHEMBL29496997

CC(C)(C)OC(=O)N1CC(OCc2cccc(SC(F)(F)F)c2)C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
RORC P51449 1/20 0.39
TACR1 P25103 3/20 0.39
CHRM3 P20309 1/20 0.39
BACE1 P56817 2/20 0.38
BACE2 Q9Y5Z0 1/20 0.38
CARM1 Q86X55 1/20 0.38
PRMT6 Q96LA8 1/20 0.38
MGLL Q99685 2/20 0.38
FAAH O00519 1/20 0.38
NAMPT P43490 1/20 0.38
GPR119 Q8TDV5 2/20 0.37
UBE2M P61081 1/20 0.37
DCUN1D1 Q96GG9 1/20 0.37
USP30 Q70CQ3 2/20 0.36
KAT6A Q92794 1/20 0.36
KAT5 Q92993 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
SCHEMBL25297006 1.00 PRMT5 (0.41) PRMT5WDR77FFAR4RORCTACR1
SCHEMBL25294994 0.87 DDB1 (0.42) PRMT5WDR77RORCTACR1BACE1
SCHEMBL25298990 0.85 FFAR4 (0.46) FFAR4CHRM3CARM1PRMT6MGLL
SCHEMBL24168673 0.84 MGLL (0.50) RORCTACR1CHRM3CARM1PRMT6
SCHEMBL30334881 0.84 MGLL (0.50) RORCTACR1CHRM3CARM1PRMT6
SCHEMBL25326344 0.82 GPR119 (0.43) PRMT5WDR77RORCNAMPTGPR119
SCHEMBL22290386 0.81 USP30 (0.46) PRMT5WDR77RORCCHRM3BACE1
SCHEMBL29497059 0.81 PRMT5 (0.44) PRMT5WDR77RORCTACR1CHRM3
SCHEMBL25300513 0.81 PRMT5 (0.44) PRMT5WDR77RORCTACR1CHRM3
SCHEMBL9938446 0.80 PRMT5 (0.51) PRMT5WDR77RORCTACR1BACE1

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
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 (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-20220098176-A1 HETEROCYCLIC COMPOUNDS CBR3, BRIX1, CCNY PRMT5 949/4885WDR77 3761/4885FFAR4 4405/4885

“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.