SCHEMBL23748868

SCHEMBL23748868

Cc1cc(C[C@@H](N)C(=O)N2CCN(C3CCN(C)CC3)CC2)cc2cn[nH]c12

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.58
CALCRL Q16602 1/20 0.58
CALCA P06881 19/20 0.54

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
SCHEMBL30799385 1.00 CYP3A4 (0.58) CYP3A4CALCRLCALCA
SCHEMBL5660417 1.00 CYP3A4 (0.58) CYP3A4CALCRLCALCA
SCHEMBL5658602 0.96 CALCA (0.56) CYP3A4CALCRLCALCA
SCHEMBL5661665 0.96 CALCRL (0.56) CYP3A4CALCRLCALCA
Trifluoroacetic Acid SCHEMBL31430917 0.94 CYP3A4 (0.53) CYP3A4CALCRLCALCA
Trifluoroacetic Acid SCHEMBL31180093 0.94 CYP3A4 (0.53) CYP3A4CALCRLCALCA
SCHEMBL5658251 0.93 CALCA (0.56) CYP3A4CALCRLCALCA
SCHEMBL3605516 0.92 CALCRL (0.57) CALCRLCALCA
SCHEMBL5660491 0.91 CALCA (0.53) CALCRLCALCA
SCHEMBL4862077 0.90 CYP3A4 (0.48) CYP3A4CALCRLCALCA

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
CN-117551081-A New preparation method of migraine therapeutic drug 北京康立生医药技术开发有限公司 2024-02-13 CN claimed
EP-4703362-A1 COMPOUND CONTAINING OXO-PYRIDO-ALIPHATIC RING OR ALIPHATIC HETEROCYCLIC STRUCTURE, AND MEDICAL USE THEREOF Chengdu Sibeibo Pharmaceutical Technology Co., Ltd (CN) 2026-03-04 EP disclosed
CN-119306709-A Synthesis method of compound containing oxo-pyrido alicyclic heterocycle or alicyclic structure and novel intermediate 成都思倍博医药科技有限公司 2025-01-14 CN disclosed
WO-2024046223-A1 INDAZOLE FORMAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR, AND USE THEREOF 熙源安健医药(上海)有限公司 2024-03-07 WO disclosed
CN-117624191-A Indazole carboxamide derivatives, preparation method and application thereof 熙源安健医药(上海)有限公司 2024-03-01 CN disclosed
CN-117551081-A New preparation method of migraine therapeutic drug 北京康立生医药技术开发有限公司 2024-02-13 CN disclosed
US-20210395223-A1 PRODRUGS OF CGRP ANTAGONISTS PFIZER IRELAND PHARMACEUTICALS (IE) 2021-12-23 US disclosed
EP-3863629-A1 PRODRUGS OF CGRP ANTAGONISTS Biohaven Pharmaceutical Holding Company Ltd. (US) 2021-08-18 EP disclosed
CN-112888438-A Prodrugs of CGRP antagonists 拜尔哈文制药股份有限公司 2021-06-01 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 (1 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-20210395223-A1 PRODRUGS OF CGRP ANTAGONISTS CALCRL, CALCA, CALCB CYP3A4 1440/4885CALCRL 1/4885CALCA 2/4885

“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.