SCHEMBL29327279

SCHEMBL29327279

C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1c1ccc(F)cc1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.47
HDAC2 Q92769 1/20 0.47
USP30 Q70CQ3 2/20 0.46
GPR119 Q8TDV5 4/20 0.45
GRM5 P41594 1/20 0.44
GRM1 Q13255 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
POLB P06746 1/20 0.43
RORC P51449 3/20 0.43
TP53 P04637 1/20 0.42
LIPE Q05469 1/20 0.42

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
SCHEMBL29327296 0.87 GPR119 (0.56) USP30GPR119MEN1KMT2ATP53
SCHEMBL21876801 0.86 USP30 (0.51) USP30GPR119RORC
SCHEMBL29327437 0.86 MEN1 (0.50) USP30GPR119MEN1KMT2ATP53
SCHEMBL5725565 0.86 NR1H2 (0.46) USP30GPR119LIPE
SCHEMBL18043598 0.86 GPR119 (0.56) USP30GPR119POLBRORC
SCHEMBL18061524 0.86 GPR119 (0.56) USP30GPR119POLBRORC
SCHEMBL29327425 0.85 ADAMTS5 (0.50) HDAC1HDAC2USP30GPR119RORC
SCHEMBL29327274 0.84 GRM5 (0.48) USP30GPR119GRM5GRM1RORC
SCHEMBL30040129 0.83 GPR119 (0.47) USP30GPR119GRM1
SCHEMBL28590437 0.83 MAPT (0.46) HDAC1USP30GPR119MEN1KMT2A

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-20240238281-A1 PIPERAZINE DERIVATIVES AND APPLICATION THEREOF GUANGZHOU BAIYUNSHAN PHARMACEUTICAL HOLDINGS CO., LTD. BAIYUNSHAN PHARMACEUTICAL GENERAL FACTORY (CN) 2024-07-18 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-20240238281-A1 PIPERAZINE DERIVATIVES AND APPLICATION THEREOF AQP3, SLC6A7, ABCG2 HDAC1 324/4885HDAC2 84/4885USP30 2950/4885

“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.