SCHEMBL20705196

SCHEMBL20705196

C1=CN=Cc2ccccc2N=1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 3/20 0.32

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
SCHEMBL18935284 0.72
SCHEMBL22393720 0.69 ALDH1A1 (0.32)
SCHEMBL206344 0.68 TRPA1 (0.34) TRPA1
Quinazoline SCHEMBL5078612 0.65 TRPA1 (0.35) TRPA1
SCHEMBL18935567 0.65
SCHEMBL15075855 0.63
SCHEMBL29633894 0.63
SCHEMBL30691872 0.63 TRPA1 (0.58) TRPA1
SCHEMBL5050147 0.63 TRPA1 (0.58) TRPA1
SCHEMBL9926021 0.63 TRPA1 (0.58) TRPA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025111482-A1 COMPLEXING AGENT SALT FORMULATIONS OF PHARMACEUTICAL COMPOUNDS AT LOW STOICHIOMETRIC RATIOS BEXSON BIOMEDICAL, INC. (US) 2025-05-30 WO claimed
US-20250073207-A1 PSILOCIN BENZOATE FORMULATION FOR INTRAVENOUS INFUSION ELEUSIS THERAPEUTICS US, INC. 2025-03-06 US claimed
WO-2024127333-A1 CYTOTOXIC COMPOUNDS PHEON THERAPEUTICS LTD (GB) 2024-06-20 WO claimed
CN-117263873-A 1, 4-benzodiazepine compounds and application thereof in preparation of antitumor drugs 复旦大学 2023-12-22 CN claimed
WO-2023241738-A2 1,4-BENZODIAZEPINE COMPOUND AND USE THEREOF IN PREPARATION OF ANTI-TUMOR DRUG 复旦大学 2023-12-21 WO claimed
US-20230277568-A1 METHOD OF TREATMENT FOR PSILOCYBIN OR PSILOCIN INFUSION ELEUSIS THERAPEUTICS US, INC. 2023-09-07 US claimed
CN-115925642-A Synthesis method of 1, 4-benzodiazepine heterocyclic derivative 枣庄学院 2023-04-07 CN claimed
CN-115368371-A Chiral triazine heterocyclic spiro-conjugated 1, 4-benzodiazepine-2-one compound and preparation method thereof 北京工业大学 2022-11-22 CN claimed
CN-112851691-B Chiral oxadiazine heterocyclic compound and preparation method thereof 北京工业大学 2022-10-11 CN claimed
CN-112574220-B Chiral heterocyclic compound and preparation method thereof 北京工业大学 2022-10-11 CN claimed
EP-0024272-B1 1,4-BENZODIAZEPINES AND THEIR SALTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Kali-Chemie Pharma GmbH (DE) 1982-12-08 EP claimed
US-4362732-A Diazepine derivatives and their use HOFFMANN-LA ROCHE INC. (US) 1982-12-07 US claimed
US-4352817-A ANTIDOTE FOR TRANQUILLIZING EFFECTS OF 1,4-BENZODIAZEPINES HOFFMANN-LA ROCHE INC. (US) 1982-10-05 US claimed
US-4352818-A ANTIDOTES FOR INTOXICATION CAUSED BY 1,4-BENZODIAZEPINE TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-10-05 US claimed
US-4338314-A [1,2]Anellated-7-phenyl-1,4-benzodiazepine and pharmaceutical compositions thereof and use for treatment of ulcers KALI-CHEMIE PHARMA GMBH (DE) 1982-07-06 US claimed
US-4316897-A TRANQUILIZERS HOFFMANN-LA ROCHE INC. (US) 1982-02-23 US claimed
US-4170649-A 2-SUBSTITUTED BY CYANOMETHYLENE OR CARBAMOYLMETHYLENE, TRANQUILIZERS, OXIDIZING CORRESPONDING CYANOMETHYL COMPOUNDS, OPTIONAL HYDROLYSIS KALI-CHEMIE PHARMA GMBH (DE) 1979-10-09 US claimed
US-4155904-A Process for the preparation of 1,4-benzo-diazepines and 1,4-benzodiazepinones SCHERING CORPORATION (US) 1979-05-22 US claimed
US-4145417-A TRANQUILIZERS, SEDATIVES, HYPNOTICS, ADDUCTS WITH ALDEHYDES DDSA PHARMACEUTICLAS LTD. (GB) 1979-03-20 US claimed
US-4083948-A IODINE LABELS HOFFMANN-LA ROCHE, INC. (US) 1978-04-11 US claimed

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-20250073207-A1 PSILOCIN BENZOATE FORMULATION FOR INTRAVENOUS INFUSION SRI, PROC, PRDX6 TRPA1 2870/4885
US-20230277568-A1 METHOD OF TREATMENT FOR PSILOCYBIN OR PSILOCIN INFUSION PNN, HTR1B, GABBR1 TRPA1 1366/4885

“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.