SCHEMBL25390798

SCHEMBL25390798

CC(C)(C)OC(=O)N1CC(Sc2cc(C(=O)O)ccn2)C1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 1/20 0.44
▸ CRBN Q96SW2 1/20 0.44
▸ USP30 Q70CQ3 3/20 0.40
▸ GPR119 Q8TDV5 6/20 0.39
▸ RORC P51449 1/20 0.38
▸ POLB P06746 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ KDM4A O75164 1/20 0.37
▸ KDM5C P41229 1/20 0.37
▸ KDM4C Q9H3R0 1/20 0.37
▸ KDM3A Q9Y4C1 1/20 0.37
▸ HCRTR2 O43614 1/20 0.37

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
SCHEMBL24473906 0.88 HCRTR2 (0.48) USP30GPR119KDM4EKDM5CKDM4C
SCHEMBL17560179 0.78 NOS1 (0.44) USP30
SCHEMBL322089 0.77 USP30 (0.45) DDB1CRBNUSP30GPR119RORC
SCHEMBL24473752 0.77 PIK3CA (0.42) USP30GPR119RORCPOLB
SCHEMBL24462341 0.76 DDB1 (0.59) DDB1CRBNKDM4EKDM4AKDM5C
SCHEMBL29630836 0.76 DDB1 (0.59) DDB1CRBNKDM4EKDM4AKDM5C
SCHEMBL20951081 0.74 KDM2B (0.54) DDB1CRBNKDM4EKDM4AKDM5C
SCHEMBL20938623 0.73 PIK3CA (0.56) GPR119POLB
SCHEMBL15212446 0.72 RORC (0.50) USP30GPR119RORCKDM4E
SCHEMBL17572116 0.72 GPR119 (0.53) GPR119

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-20230286968-A1 ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HOFFMANN-LA ROCHE INC. (US) 2023-09-14 — — 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-20230286968-A1 ARYLOXAZOLO SPIRAL RING DERIVATIVES FOR THE TREATMENT AND PROPHYLAXIS OF HEPATITIS B VIRUS INFECTION HAVCR2, CYP4B1, CYP1B1 DDB1 660/4885CRBN 979/4885USP30 3455/4885

“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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