SCHEMBL25216672

SCHEMBL25216672

CC(COc1ccccc1Cc1ccccc1)OS(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 10/20 0.47
DRD1 P21728 5/20 0.47
DRD2 P14416 4/20 0.47
DRD4 P21917 4/20 0.47
DRD5 P21918 4/20 0.47
TP53 P04637 1/20 0.46
CYP1A2 P05177 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HPGD P15428 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
DRD3 P35462 4/20 0.45
LMNA P02545 1/20 0.45
HTR1A P08908 1/20 0.40
ADRA1D P25100 1/20 0.40
ADRA1A P35348 1/20 0.40
ADRA1B P35368 1/20 0.40

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
SCHEMBL25259239 1.00 HRH1 (0.47) HRH1DRD1DRD2DRD4DRD5
SCHEMBL25218614 1.00 HRH1 (0.47) HRH1DRD1DRD2DRD4DRD5
SCHEMBL17664993 0.82 HRH1 (0.41) HRH1DRD1DRD2DRD4DRD5
SCHEMBL22974801 0.82 HRH1 (0.41) HRH1DRD1DRD2DRD4DRD5
SCHEMBL17660558 0.82 HRH1 (0.41) HRH1DRD1DRD2DRD4DRD5
SCHEMBL6249983 0.82 ALDH1A1 (0.47) DRD1DRD2L3MBTL1HPGDSMN1; SMN2
SCHEMBL6248039 0.82 ALDH1A1 (0.47) DRD1DRD2L3MBTL1HPGDSMN1; SMN2
SCHEMBL28501337 0.80 ALDH1A1 (0.39) HRH1DRD1DRD2DRD4DRD5
SCHEMBL17660559 0.79 HRH1 (0.57) HRH1DRD1DRD2DRD4DRD5
SCHEMBL4853522 0.78 LMNA (0.49) CYP1A2L3MBTL1SMN1; SMN2LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12227477-B2 Method for preparing single isomer of 1-(1-(2-benzylphenoxy)propan-2-yl)-2-methylpiperidine in high-purity VSpharmtech (KR) 2025-02-18 US disclosed
US-20240174609-A1 METHOD FOR PREPARING SINGLE ISOMER OF 1-(1-(2-BENZYLPHENOXY)PROPAN-2-YL)-2-METHYLPIPERIDINE IN HIGH-PURITY VSpharmtech (KR) 2024-05-30 US disclosed
EP-4212512-A1 PREPARATION METHOD FOR HIGH PURITY 1-(1-(2-BENZYL PHENOXY)PROPAN-2-YL)-2-METHYLPIPERIDINE SINGLE ISOMER VSpharmtech Inc. (KR) 2023-07-19 EP disclosed
WO-2023101115-A1 PREPARATION METHOD FOR HIGH PURITY 1-(1-(2-BENZYL PHENOXY)PROPAN-2-YL)-2-METHYLPIPERIDINE SINGLE ISOMER 주식회사 브이에스팜텍 2023-06-08 WO 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 (2 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-12227477-B2 Method for preparing single isomer of 1-(1-(2-benzylphenoxy)propan-2-yl)-2-methylpiperidine in high-purity MBD2, PDE1C, NPEPPS HRH1 1172/4885DRD1 42/4885DRD2 25/4885
US-20240174609-A1 METHOD FOR PREPARING SINGLE ISOMER OF 1-(1-(2-BENZYLPHENOXY)PROPAN-2-YL)-2-METHYLPIPERIDINE IN HIGH-PURITY MBD2, PDE1C, NPEPPS HRH1 1172/4885DRD1 42/4885DRD2 25/4885

“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.