⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL5427128 | 0.91 | CYP2D6 (0.46) | — | |
| SCHEMBL8591342 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL2222378 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL8472769 | 0.84 | — | — | |
| SCHEMBL13961615 | 0.80 | CYP2D6 (0.43) | — | |
| SCHEMBL2179752 | 0.79 | — | — | |
| SCHEMBL11338109 | 0.77 | CYP2D6 (0.48) | — | |
| Hydrochloric Acid SCHEMBL5795716 | 0.77 | POLB (0.46) | — | |
| Hydrochloric Acid SCHEMBL2984217 | 0.77 | POLB (0.46) | — | |
| Hydrochloric Acid SCHEMBL2984220 | 0.77 | POLB (0.46) | — |
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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103732589-B | Can be used as the sulphonamide of the replacement of anti-apoptotic BCL inhibitor | BRISTOL-MYERS SQUIBB CO. (US) | 2016-03-30 | — | — | CN | disclosed |
| CN-104903320-A | Nitrogen-containing heterocylic compound or salt thereof | FUJIFILM CORP | 2015-09-09 | — | — | CN | disclosed |
| CN-101426772-B | Benzotriazine inhibitors of kinases | TARGEGEN INC | 2014-01-08 | — | — | CN | disclosed |
| CN-103183674-A | Fused heterocycle derivative and application thereof | JIANGSU SIMCERE PHARM RES CO | 2013-07-03 | — | — | CN | disclosed |
| CN-103044418-A | Asymmetric synthesis method, relevant raw materials and preparation method of (S,S)-2,8-diazabicyclo[4,3,0] nonane | SHANGHAI PUYI CHEM TECH CO LTD | 2013-04-17 | — | — | CN | disclosed |
| CN-101528688-B | Process for preparing indole-5-oxoquinazoline derivatives and intermediates | ASTRAZENECA AB | 2012-09-05 | — | — | CN | disclosed |
| CN-102617502-A | Benzoxazole derivatives and application of benzoxazole derivatives to medicines | JIANGSU SIMCERE PHARM RES CO | 2012-08-01 | — | — | CN | disclosed |
| CN-102584798-A | Process for preparing indol- 5 -oxy- quinazoline derivatives and intermediates | ASTRAZENECA AB | 2012-07-18 | — | — | CN | disclosed |
| CN-102532108-A | Process for preparing indol-5-oxy-quinazoline derivatives and intermediates | ASTRAZENECA AB | 2012-07-04 | — | — | CN | disclosed |
| CN-101560179-B | Azotic indole derivative with H3 receptor affinity and applications | UNIV ZHEJIANG | 2012-04-18 | — | — | CN | disclosed |
| CN-1308310-C | Nitrogen-containing aromatic ring derivatives | EISAI CO LTD (JP) | 2007-04-04 | — | — | CN | disclosed |
| CN-1922183-A | Nitrogenous fused heteroaromatic ring derivative | BANYU PHARMA CO LTD (JP) | 2007-02-28 | — | — | CN | disclosed |
| CN-1147492-C | New metal protease inhibitors, its preparing method and their medicinal composition containing them | ɪά��ʵ���� | 2004-04-28 | — | — | CN | disclosed |
| CN-1142920-C | Quinazoline derivatives and pharmaceutical compositions containing them | — | 2004-03-24 | — | — | CN | disclosed |
| EP-0850953-B1 | Polymers, elastomeric compounds, and products thereof, terminated with amine compounds containing side-chain organohalide reactive moieties | BRIDGESTONE CORP (JP) | 2002-06-12 | — | — | EP | disclosed |
| CN-1231662-A | Quinazoline derivatives and pharmaceutical compositions containing them | ZENNECA LTD (GB) | 1999-10-13 | — | — | CN | disclosed |
| US-5916976-A | Polymers, elastomeric compounds, and products thereof, terminated with novel amine compounds containing side-chain organohalide reactive moieties | BRIDGESTONE CORPORATION (JP) | 1999-06-29 | — | — | US | disclosed |
| EP-0850953-A1 | Polymers, elastomeric compounds, and products thereof, terminated with novel amine compounds containing side-chain organohalide reactive moieties | Bridgestone Corporation (JP) | 1998-07-01 | — | — | EP | disclosed |
| US-5736617-A | LIVING END IS REACTED WITH CYCLIC AMINE CONTAINING ORGANOHALIDE SIDE CHAIN | BRIDGESTONE CORPORATION (JP) | 1998-04-07 | — | — | US | disclosed |
| CN-1100716-A | Basic ethers and process for the preparation thereof | EGYT GYOGYSZERVEGYESZETI GYAR (HU) | 1995-03-29 | — | — | CN | disclosed |