SCHEMBL971072

SCHEMBL971072

CC(C)C(Br)C(N)=O

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL24211928 1.00
SCHEMBL7520886 0.81
SCHEMBL7518983 0.81
SCHEMBL7521176 0.81
SCHEMBL7518978 0.81
SCHEMBL7520492 0.81
SCHEMBL16401948 0.79 CYP2C19 (0.44)
SCHEMBL7516847 0.79
SCHEMBL7522694 0.79
SCHEMBL7521384 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2948177-A1 METHODS FOR OPTIMIZING DOMAIN STABILITY OF BINDING PROTEINS AbbVie Inc. (US) 2015-12-02 EP claimed
WO-2014116596-A1 METHODS FOR OPTIMIZING DOMAIN STABILITY OF BINDING PROTEINS ABBVIE, INC. (US) 2014-07-31 WO claimed
WO-2023136279-A1 CRYSTAL OF SUBSTITUTED PIPERIDINE COMPOUND, SALTS OF SUBSTITUTED PIPERIDINE COMPOUND, AND CRYSTALS THEREOF エーザイ・アール・アンド・ディー・マネジメント株式会社 2023-07-20 WO disclosed
CN-115884971-A Substituted piperidine compounds and uses thereof 卫材R&D管理有限公司 2023-03-31 CN disclosed
WO-2022014680-A1 SUBSTITUTED PIPERIDINE COMPOUND AND APPLICATION THEREOF エーザイ・アール・アンド・ディー・マネジメント株式会社 2022-01-20 WO disclosed
CN-109776537-A Purinedione as WNT pathway modulators 新加坡科技研究局 2019-05-21 CN disclosed
EP-3313825-A1 GLUCOSE UPTAKE INHIBITORS Kadmon Corporation, LLC (US) 2018-05-02 EP disclosed
WO-2016210330-A1 GLUCOSE UPTAKE INHIBITORS KADMON CORPORATION, LLC (US) 2016-12-29 WO disclosed
US-20160113930-A1 COMPOUNDS FOR USE IN TREATING RETT SYNDROME VITAE PHARMACEUTICALS, INC. 2016-04-28 US disclosed
US-20160113930-A1 COMPOUNDS FOR USE IN TREATING RETT SYNDROME VITAE PHARMACEUTICALS, INC. 2016-04-28 US disclosed
CN-103130652-A Method preparing aromatic primary amine compound from phenol type compound UNIV ZHEJIANG 2013-06-05 CN disclosed
US-7868032-B2 Prostamide receptor antagonists ALLERGAN, INC. (US) 2011-01-11 US disclosed
WO-2009143485-A1 DIAZONAMIDE ANALOGS JOYANT PHARMACEUTICALS, INC. (US) 2009-11-26 WO disclosed
US-20080096240-A1 NOVEL PROSTAMIDE RECEPTOR ANTAGONISTS WOODWARD DAVID F 2008-04-24 US disclosed
EP-1660439-A2 ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE Transtech Pharma, Inc. (US) 2006-05-31 EP disclosed
WO-2005014533-A2 ARYL AND HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE TRANSTECH PHARMA, INC. (US) 2005-02-17 WO disclosed