SCHEMBL29367334

SCHEMBL29367334

NC(=O)CC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@@H](N)CSSCC(C(=O)N2CCCC2C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@H](CC(N)=O)NC1=O

nearest known ligand 0.89

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ AVPR1A P37288 3/20 0.89
▸ AVPR2 P30518 2/20 0.89
▸ OXTR P30559 2/20 0.89
▸ AVPR1B P47901 2/20 0.89
▸ PTGS1 P23219 1/20 0.78

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
SCHEMBL29934390 1.00 AVPR1A (0.89) AVPR1AAVPR2OXTRAVPR1BPTGS1
SCHEMBL30525288 1.00 AVPR1A (0.89) AVPR1AAVPR2OXTRAVPR1BPTGS1
Vasopressin SCHEMBL18937546 0.94 AVPR1A (1.00) AVPR1AAVPR2OXTRAVPR1BPTGS1
Vasopressin SCHEMBL29688276 0.94 AVPR1A (1.00) AVPR1AAVPR2OXTRAVPR1BPTGS1
Vasopressin SCHEMBL19712236 0.94 AVPR1A (1.00) AVPR1AAVPR2OXTRAVPR1BPTGS1
Vasopressin SCHEMBL17874853 0.94 AVPR1A (1.00) AVPR1AAVPR2OXTRAVPR1BPTGS1
Vasopressin SCHEMBL29530914 0.93 AVPR1A (0.97) AVPR1AAVPR2OXTRAVPR1BPTGS1
SCHEMBL23879427 0.92 AVPR1A (0.96) AVPR1AAVPR2OXTRAVPR1BPTGS1
SCHEMBL18476287 0.92 AVPR1A (0.96) AVPR1AAVPR2OXTRAVPR1BPTGS1
SCHEMBL29786906 0.92 AVPR1A (0.74) AVPR1AAVPR2OXTRAVPR1BPTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240316143-A1 THERAPEUTIC AGENTS AND/OR PHARMACEUTICAL COMPOSITIONS FOR NEUROCOGNITIVE DISORDERS IMAMURA Jyunichi (JP) 2024-09-26 — — US claimed
US-12478612-B2 Deuterated domperidone compositions, methods, and preparation CINDOME PHARMA, INC. (US) 2025-11-25 — — US disclosed
US-20240316143-A1 THERAPEUTIC AGENTS AND/OR PHARMACEUTICAL COMPOSITIONS FOR NEUROCOGNITIVE DISORDERS IMAMURA Jyunichi (JP) 2024-09-26 — — US disclosed
WO-2024142211-A1 THERAPEUTIC AGENT FOR DEMENTIA 今村 純一 2024-07-04 — — WO disclosed
US-20240091199-A1 Deuterated Domperidone Compositions, Methods, and Preparation CINDOME PHARMA, INC. (US) 2024-03-21 — — US disclosed
CN-116712432-A Deuterated domperidone compositions, methods and preparations 辛多美制药有限公司 2023-09-08 — — CN disclosed
CN-111093653-B Deuterated domperidone compositions, methods and preparations 辛多美制药有限公司 2023-06-23 — — CN disclosed
US-11364226-B2 Deuterated domperidone compositions, methods, and preparation CINRX PHARMA, LLC (US) 2022-06-21 — — US disclosed
CN-113995755-A Deuterated domperidone composition and method for treating disorders 辛多美制药有限公司 2022-02-01 — — 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-20240091199-A1 Deuterated Domperidone Compositions, Methods, and Preparation DRD2, DRD1, DRD4 AVPR1A 43/4885AVPR2 11/4885OXTR 250/4885
US-20240316143-A1 THERAPEUTIC AGENTS AND/OR PHARMACEUTICAL COMPOSITIONS FOR NEUROCOGNITIVE DISORDERS AVPR1A, AVPR2, AVPR1B AVPR1A 1/4885AVPR2 2/4885OXTR 30/4885
US-11364226-B2 Deuterated domperidone compositions, methods, and preparation DRD2, DRD1, DRD4 AVPR1A 43/4885AVPR2 11/4885OXTR 250/4885
US-12478612-B2 Deuterated domperidone compositions, methods, and preparation DRD2, DRD1, DRD4 AVPR1A 43/4885AVPR2 11/4885OXTR 250/4885

“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.

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