SCHEMBL21584005

SCHEMBL21584005

CC(C)(C)OC(=O)N[C@H]1CCN(CCCF)C1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSK P43235 2/20 0.53
HRH2 P25021 4/20 0.48
HRH1 P35367 4/20 0.48
KCNA3 P22001 1/20 0.47
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
HSD11B1 P28845 4/20 0.46
CYP2C9 P11712 1/20 0.46
CCR5 P51681 1/20 0.42
DRD2 P14416 2/20 0.42
BTK Q06187 1/20 0.41
JAK2 O60674 2/20 0.40
JAK1 P23458 2/20 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
SCHEMBL24036902 1.00 CTSK (0.53) CTSKHRH2HRH1KCNA3CA1
SCHEMBL1700415 0.92 CTSK (0.56) CTSKHRH2HRH1KCNA3CA1
SCHEMBL1700413 0.92 CTSK (0.56) CTSKHRH2HRH1KCNA3CA1
SCHEMBL24690239 0.92 KCNA3 (0.54) CTSKHRH2HRH1KCNA3CA1
SCHEMBL1810659 0.92 CTSK (0.56) CTSKHRH2HRH1KCNA3CA1
SCHEMBL24098366 0.91 CA1 (0.49) CTSKHRH2HRH1KCNA3CA1
SCHEMBL20089656 0.89 CTSK (0.45) CTSKHRH2HRH1KCNA3CA1
SCHEMBL13583443 0.88 CTSK (0.54) CTSKHRH2HRH1KCNA3CA1
SCHEMBL13583442 0.88 CTSK (0.54) CTSKHRH2HRH1KCNA3CA1
SCHEMBL25700736 0.87 CTSK (0.51) CTSKHRH2HRH1KCNA3CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12428428-B2 Tricyclic tetrahydroisoquinoline derivative, preparation method therefor and application thereof in medicine JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2025-09-30 US disclosed
EP-4577534-A1 NOVEL SUBSTITUTED TETRAHYDROISOQUINOLINE-6- CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF Sanofi (FR) 2025-07-02 EP disclosed
EP-4577531-A1 NOVEL SUBSTITUTED 2-CARBONYL-BENZOTHIOPHENE-6- CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF Sanofi (FR) 2025-07-02 EP disclosed
CN-119907798-A Novel substituted 2,3,4, 9-tetrahydro-1H-pyrido [3,4-B ] indolecarboxylic acid derivatives, process for their preparation and their therapeutic use 赛诺菲 2025-04-29 CN disclosed
CN-119790046-A Novel substituted 2-carbonyl-benzothiophene-6-carboxylic acid derivatives, process for their preparation and their therapeutic use 赛诺菲 2025-04-08 CN disclosed
CN-119790048-A Novel substituted tetrahydroisoquinoline-6-carboxylic acid derivatives, process for their preparation and their therapeutic use 赛诺菲 2025-04-08 CN disclosed
US-11999728-B2 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2024-06-04 US disclosed
WO-2024042152-A1 NOVEL SUBSTITUTED 2-CARBONYL-BENZOTHIOPHENE-6- CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-02-29 WO disclosed
WO-2024042185-A1 NOVEL SUBSTITUTED TETRAHYDROISOQUINOLINE-6- CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF. SANOFI (FR) 2024-02-29 WO disclosed
WO-2024042163-A1 NOVEL SUBSTITUTED 2,3,4,9-TETRAHYDRO-1H-PYRIDO[3,4-B]INDOLE CARBOXYLIC ACID DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND THERAPEUTIC USES THEREOF SANOFI (FR) 2024-02-29 WO disclosed
WO-2023083283-A1 DRUG COMBINATION FOR TREATING TUMOR, AND APPLICATION THEREOF 先声药业有限公司 2023-05-19 WO disclosed
US-20230140679-A1 TRICYCLIC TETRAHYDROISOQUINOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2023-05-04 US disclosed
US-20230140679-A1 TRICYCLIC TETRAHYDROISOQUINOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2023-05-04 US disclosed
US-20220235050-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC 2022-07-28 US disclosed
CN-114746424-A Tricyclic tetrahydro isoquinoline derivative, preparation method and medical application thereof 江苏恒瑞医药股份有限公司 2022-07-12 CN disclosed
WO-2022140744-A1 ESTROGEN RECEPTOR MODULATORS RECURIUM IP HOLDINGS, LLC (US) 2022-06-30 WO disclosed
US-11339162-B1 Estrogen receptor modulators RECURIUM IP HOLDINGS, LLC (US) 2022-05-24 US disclosed
WO-2021228210-A1 PYRROLIDINE COMPOUND AND USE THEREOF 江苏先声药业有限公司 2021-11-18 WO disclosed
WO-2021139756-A1 TRICYCLIC TETRAHYDROISOQUINOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE 江苏恒瑞医药股份有限公司 2021-07-15 WO disclosed
WO-2019228443-A1 SELECTIVE ESTROGEN RECEPTOR DOWNREGULATORS AND USES THEREOF DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) 2019-12-05 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 (5 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-12428428-B2 Tricyclic tetrahydroisoquinoline derivative, preparation method therefor and application thereof in medicine CYP19A1, GPER1, HSD17B11 CTSK 2960/4885HRH2 1151/4885HRH1 636/4885
US-20230140679-A1 TRICYCLIC TETRAHYDROISOQUINOLINE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF IN MEDICINE CYP19A1, GPER1, HSD17B11 CTSK 2960/4885HRH2 1151/4885HRH1 636/4885
US-11339162-B1 Estrogen receptor modulators ESR2, GPER1, ESRRA CTSK 3987/4885HRH2 2585/4885HRH1 2247/4885
US-11999728-B2 Estrogen receptor modulators ESR2, GPER1, ESRRA CTSK 3987/4885HRH2 2585/4885HRH1 2247/4885
US-20220235050-A1 ESTROGEN RECEPTOR MODULATORS ESR2, GPER1, ESRRA CTSK 3987/4885HRH2 2585/4885HRH1 2247/4885

“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.