SCHEMBL29327437

SCHEMBL29327437

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
NPSR1 Q6W5P4 3/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
HTT P42858 1/20 0.48
MDM2 Q00987 1/20 0.48
USP2 O75604 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
STS P08842 2/20 0.46
LMNA P02545 3/20 0.46
GPR119 Q8TDV5 3/20 0.45
CNR1 P21554 1/20 0.44
ALDH1A1 P00352 1/20 0.43
GAA P10253 1/20 0.43
TP53 P04637 1/20 0.42
PSEN1 P49768 1/20 0.42
PSEN2 P49810 1/20 0.42
APH1B Q8WW43 1/20 0.42
NCSTN Q92542 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) MEN1KMT2ASMN1; SMN2LMNAGPR119
SCHEMBL21876801 0.86 USP30 (0.51) LMNAGPR119ALDH1A1KCNK3KCNK9
SCHEMBL29327279 0.86 HDAC1 (0.47) MEN1KMT2AGPR119TP53USP30
SCHEMBL5725565 0.86 NR1H2 (0.46) HTTLMNAGPR119ALDH1A1USP30
SCHEMBL18061524 0.86 GPR119 (0.56) GPR119USP30
SCHEMBL18043598 0.86 GPR119 (0.56) GPR119USP30
SCHEMBL23777806 0.85 STS (0.48) MEN1KMT2ASMN1; SMN2STSGPR119
SCHEMBL30040129 0.83 GPR119 (0.47) GPR119USP30
SCHEMBL656085 0.83 MEN1 (0.53) MEN1KMT2ANPSR1SMN1; SMN2HTT
SCHEMBL652990 0.83 MEN1 (0.53) MEN1KMT2ANPSR1SMN1; SMN2HTT

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 MEN1 3896/4885KMT2A 3186/4885NPSR1 245/4885

“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.