SCHEMBL21025690

SCHEMBL21025690

CNC(=O)N1CC(CC(C)(C)C)C1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.46
THRA P10827 1/20 0.34
THRB P10828 1/20 0.34
GRM5 P41594 1/20 0.33
GRM7 Q14831 1/20 0.33
GRM3 Q14832 1/20 0.33
NAMPT P43490 1/20 0.32
NR1H2 P55055 1/20 0.31
HDAC2 Q92769 1/20 0.31
LMNA P02545 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
SCHEMBL24449439 0.85 POLB (0.45) POLBTHRATHRBGRM5GRM7
SCHEMBL24449903 0.85 POLB (0.45) POLBTHRATHRBGRM5GRM7
SCHEMBL24449725 0.85 POLB (0.45) POLBTHRATHRBGRM5GRM7
SCHEMBL21025172 0.83 POLB (0.42) POLBGRM5GRM7GRM3NAMPT
SCHEMBL24449753 0.82 LMNA (0.47) THRATHRBNAMPTLMNA
SCHEMBL24449795 0.81 KMT2A (0.53) POLBTHRATHRBNAMPTLMNA
SCHEMBL25947760 0.79 SMN1; SMN2 (0.43) POLB
SCHEMBL1708559 0.79 POLB (0.50) POLBGRM5GRM7GRM3NR1H2
SCHEMBL1707651 0.79 POLB (0.50) POLBGRM5GRM7GRM3HDAC2
SCHEMBL13861304 0.78 POLB (0.48) POLBGRM5GRM7GRM3NAMPT

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-20230357208-A1 MYST FAMILY HISTONE ACETYLTRANSFERASE INHIBITORS Epizyme, Inc. (US) 2023-11-09 US disclosed
US-11685732-B2 MYST family histone acetyltransferase inhibitors Epizyme, Inc. (US) 2023-06-27 US disclosed
US-20220162197-A1 MYST FAMILY HISTONE ACETYLTRANSFERASE INHIBITORS Epizyme, Inc. 2022-05-26 US disclosed
US-10669252-B2 Benzazepine derivative, preparation method, pharmaceutical composition and use thereof Shanghai De Novo Pharmatech Co., Ltd. (CN) 2020-06-02 US disclosed
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF Shanghai De Novo Pharmatech Co., Ltd. (CN) 2019-05-23 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 (5 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-20220162197-A1 MYST FAMILY HISTONE ACETYLTRANSFERASE INHIBITORS EP300, KAT2A, KAT6A POLB 1578/4885THRA 3107/4885THRB 2099/4885
US-20230357208-A1 MYST FAMILY HISTONE ACETYLTRANSFERASE INHIBITORS EP300, KAT2A, KAT6A POLB 1578/4885THRA 3107/4885THRB 2099/4885
US-11685732-B2 MYST family histone acetyltransferase inhibitors EP300, KAT2A, KAT6A POLB 1578/4885THRA 3107/4885THRB 2099/4885
US-10669252-B2 Benzazepine derivative, preparation method, pharmaceutical composition and use thereof TLR8, TLR1, TLR5 POLB 4281/4885THRA 2044/4885THRB 992/4885
US-20190152941-A1 BENZAZEPINE DERIVATIVE, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF TLR8, TLR1, TLR5 POLB 4281/4885THRA 2044/4885THRB 992/4885

“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.