SCHEMBL29505877

SCHEMBL29505877

O=C(O)[C@@H]1NCCc2ccccc21

nearest known ligand 0.97

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.97
NPSR1 Q6W5P4 1/20 0.97
PRCP P42785 6/20 0.56
SLC6A2 P23975 2/20 0.54
SLC6A4 P31645 2/20 0.54
GAA P10253 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.51
OPRM1 P35372 1/20 0.51
SLC22A1 O15245 1/20 0.50
MAPT P10636 1/20 0.50
MAPKAPK2 P49137 1/20 0.48

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
SCHEMBL514422 1.00 TSHR (0.97) TSHRNPSR1PRCPSLC6A2SLC6A4
SCHEMBL2303831 1.00 TSHR (0.97) TSHRNPSR1PRCPSLC6A2SLC6A4
SCHEMBL29381539 1.00 TSHR (0.97) TSHRNPSR1PRCPSLC6A2SLC6A4
SCHEMBL29597389 1.00 TSHR (0.97) TSHRNPSR1PRCPSLC6A2SLC6A4
SCHEMBL574702 1.00 TSHR (0.97) TSHRNPSR1PRCPSLC6A2SLC6A4
Ammonia Solution, Strong SCHEMBL18066416 0.98 TSHR (0.93) TSHRNPSR1PRCPSLC6A2SLC6A4
Potassium SCHEMBL18066432 0.98 TSHR (0.93) TSHRNPSR1PRCPSLC6A2SLC6A4
SCHEMBL18066413 0.98 TSHR (0.93) TSHRNPSR1PRCPSLC6A2SLC6A4
Hydrochloric Acid SCHEMBL5439604 0.98 TSHR (1.00) TSHRNPSR1PRCPSLC6A2SLC6A4
Potassium SCHEMBL18066428 0.98 TSHR (0.93) TSHRNPSR1PRCPSLC6A2SLC6A4

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112442523-B Method for preparing (R) -1,2,3, 4-tetrahydroisoquinoline-1-formic acid and derivatives thereof by enzymatic resolution 浙江大学 2024-06-21 CN claimed
CN-112481344-B Preparation method of (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivative thereof 苏州同力生物医药有限公司 2024-02-02 CN claimed
CN-114341362-B Preparation method of (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivative thereof, and levopraziquantel 苏州同力生物医药有限公司 2024-02-02 CN claimed
CN-114364658-A Preparation method and composition of levo-praziquantel and chiral intermediate thereof 苏州同力生物医药有限公司 2022-04-15 CN claimed
CN-114341362-A (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivatives thereof and preparation method of levo-praziquantel 苏州同力生物医药有限公司 2022-04-12 CN claimed
US-12612398-B2 Preparation method for (R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid, derivatives thereof and levo-praziquantel TONGLI BIOMEDICAL CO., LTD. (CN) 2026-04-28 US disclosed
US-12480148-B2 Method for preparing (s)-1,2,3,4-tetrahydroisoquinoline-1 carboxylic acid and derivatives thereof TONGLI BIOMEDICAL CO., LTD. (CN) 2025-11-25 US disclosed
CN-112442523-B Method for preparing (R) -1,2,3, 4-tetrahydroisoquinoline-1-formic acid and derivatives thereof by enzymatic resolution 浙江大学 2024-06-21 CN disclosed
CN-112442523-B Method for preparing (R) -1,2,3, 4-tetrahydroisoquinoline-1-formic acid and derivatives thereof by enzymatic resolution 浙江大学 2024-06-21 CN disclosed
CN-112442523-B Method for preparing (R) -1,2,3, 4-tetrahydroisoquinoline-1-formic acid and derivatives thereof by enzymatic resolution 浙江大学 2024-06-21 CN disclosed
CN-114341362-B Preparation method of (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivative thereof, and levopraziquantel 苏州同力生物医药有限公司 2024-02-02 CN disclosed
CN-114341362-B Preparation method of (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivative thereof, and levopraziquantel 苏州同力生物医药有限公司 2024-02-02 CN disclosed
CN-109971802-B Method for preparing (S) -1,2,3, 4-tetrahydroisoquinoline-1-formic acid and derivatives thereof by enzymatic resolution 苏州同力生物医药有限公司 2023-04-07 CN disclosed
US-20230107679-A1 Method For Preparing (S)-1,2,3,4-Tetrahydroisoquinoline-1 Carboxylic Acid and Derivatives Thereof TONGLI BIOMEDICAL CO., LTD. (CN) 2023-04-06 US disclosed
CN-109384778-B Use of a compound or a pharmaceutically acceptable salt thereof for the manufacture of a medicament for the treatment of a disease, health condition or disorder 赛克里翁治疗有限公司 2022-12-13 CN disclosed
CN-110016020-B Compound or pharmaceutically acceptable salt thereof, application and pharmaceutical composition thereof 赛克里翁治疗有限公司 2022-07-26 CN disclosed
US-20220227766-A1 PREPARATION METHOD FOR (R)-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID, DERIVATIVES THEREOF AND LEVO-PRAZIQUANTEL TONGLI BIOMEDICAL CO., LTD. (CN) 2022-07-21 US disclosed
CN-114364658-A Preparation method and composition of levo-praziquantel and chiral intermediate thereof 苏州同力生物医药有限公司 2022-04-15 CN disclosed
CN-114341362-A (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivatives thereof and preparation method of levo-praziquantel 苏州同力生物医药有限公司 2022-04-12 CN disclosed
CN-114341362-A (R) -1,2,3, 4-tetrahydroisoquinoline-1-carboxylic acid and derivatives thereof and preparation method of levo-praziquantel 苏州同力生物医药有限公司 2022-04-12 CN 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 (4 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-12480148-B2 Method for preparing (s)-1,2,3,4-tetrahydroisoquinoline-1 carboxylic acid and derivatives thereof IMPDH1, HSD17B12, COASY TSHR 3603/4885NPSR1 2703/4885PRCP 3645/4885
US-12612398-B2 Preparation method for (R)-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid, derivatives thereof and levo-praziquantel CES1, LIPA, LIPC TSHR 1129/4885NPSR1 2305/4885PRCP 570/4885
US-20230107679-A1 Method For Preparing (S)-1,2,3,4-Tetrahydroisoquinoline-1 Carboxylic Acid and Derivatives Thereof IMPDH1, COASY, ALDH18A1 TSHR 3631/4885NPSR1 2648/4885PRCP 3555/4885
US-20220227766-A1 PREPARATION METHOD FOR (R)-1,2,3,4-TETRAHYDROISOQUINOLINE-1-CARBOXYLIC ACID, DERIVATIVES THEREOF AND LEVO-PRAZIQUANTEL CES1, LIPA, PON1 TSHR 1679/4885NPSR1 2475/4885PRCP 475/4885

“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.