SCHEMBL29327274

SCHEMBL29327274

C[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H](C)N1c1cccc(F)c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 1/20 0.48
GRM1 Q13255 1/20 0.48
TP53 P04637 3/20 0.46
HPGDS O60760 2/20 0.46
USP30 Q70CQ3 2/20 0.45
GPR119 Q8TDV5 5/20 0.45
LMNA P02545 1/20 0.43
RORC P51449 1/20 0.41

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
SCHEMBL18043582 0.86 GPR119 (0.60) TP53GPR119LMNA
SCHEMBL23777806 0.86 STS (0.48) TP53GPR119
SCHEMBL30594074 0.86 GPR119 (0.60) TP53GPR119LMNA
SCHEMBL18061525 0.86 GPR119 (0.60) TP53GPR119LMNA
SCHEMBL13835355 0.85 MEN1 (0.46) TP53GPR119
SCHEMBL19690138 0.85 USP30 (0.50) USP30GPR119RORC
SCHEMBL19690137 0.85 USP30 (0.50) USP30GPR119RORC
SCHEMBL23784981 0.84 ADAMTS5 (0.52) GRM5GRM1TP53GPR119LMNA
SCHEMBL23784980 0.84 ADAMTS5 (0.52) GRM5GRM1TP53GPR119LMNA
SCHEMBL29327279 0.84 HDAC1 (0.47) GRM5GRM1TP53USP30GPR119

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 GRM5 589/4885GRM1 2308/4885TP53 2292/4885

“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.