SCHEMBL3896587

SCHEMBL3896587

N#CCN1CCC(O)C1

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
SCHEMBL4674542 1.00
SCHEMBL3896054 0.88 ALDH1A1 (0.46)
SCHEMBL3897207 0.86 GPR119 (0.50)
SCHEMBL23127108 0.81
SCHEMBL19043861 0.80 KDM2B (0.33)
SCHEMBL3442139 0.79 ALDH1A1 (0.52)
SCHEMBL3442137 0.79 ALDH1A1 (0.52)
SCHEMBL3442633 0.79 ALDH1A1 (0.52)
SCHEMBL20292998 0.78
SCHEMBL6796734 0.78

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3519393-B1 SUBSTITUTED FUSED BI- OR TRI- HETEROCYCLIC COMPOUNDS AS EHMT2 INHIBITORS EPIZYME INC (US) 2022-05-18 EP disclosed
EP-2791139-B1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS Dr Reddys Laboratories Ltd (IN) 2017-11-08 EP disclosed
US-9289419-B2 Substituted heterocyclic compounds as tropomyosin receptor kinase a (TrkA) inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2016-03-22 US disclosed
US-20150164869-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2015-06-18 US disclosed
US-9045479-B2 Substituted heterocyclic compounds as tropomyosin receptor kinase a (TrkA) inhibitors DR. REDDY'S LABORATORIES LTD. (IN) 2015-06-02 US disclosed
US-20150005280-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2015-01-01 US disclosed
EP-2791139-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS Dr. Reddy's Laboratories Ltd. (IN) 2014-10-22 EP disclosed
WO-2013088257-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AS TROPOMYOSIN RECEPTOR KINASE A (TRKA) INHIBITORS DR. REDDY'S LABORATORIES LTD. (IN) 2013-06-20 WO disclosed
US-7557215-B2 Anthraquinone compounds as anti cancer compounds SOMANTA LIMITED (GB) 2009-07-07 US disclosed
EP-1701939-B1 ANTHRAQUINONE COMPOUNDS AS ANTI CANCER COMPOUNDS SOMANTA LTD (GB) 2009-02-25 EP disclosed
EP-1453501-B1 N- ARYL-N'-ARYLCYCLOALKYL-UREA DERIVATIVES AS MCH ANTAGONISTS FOR THE TREATMENT OF OBESITY SCHERING CORP (US) 2008-08-13 EP disclosed
WO-2008062252-A1 N-OXIDES OF CYTOTOXIC ANTHRAQUINONES AS HYPOXIA-TARGETING PRODRUGS IN CANCER TREATMENT ACCESS PHARMACEUTICALS, INC (US) 2008-05-29 WO disclosed
US-7348328-B2 MCH antagonists for the treatment of obesity SCHERING CORPORATION (US) 2008-03-25 US disclosed
US-20080027107-A1 Antharquinone Compounds as Anti Cancer Compounds SOMANTA LIMITED (GB) 2008-01-31 US disclosed
EP-1701939-A1 ANTHRAQUINONE COMPOUNDS AS ANTI CANCER COMPOUNDS Somanta Limited (GB) 2006-09-20 EP disclosed
WO-2005061453-A1 ANTHARQUINONE COMPOUNDS AS ANTI CANCER COMPOUNDS SOMANTA LIMITED (GB) 2005-07-07 WO disclosed
EP-1453501-A1 N- ARYL-N'-ARYLCYCLOALKYL-UREA DERIVATIVES AS MCH ANTAGONISTS FOR THE TREATMENT OF OBESITY SCHERING CORPORATION (US) 2004-09-08 EP disclosed
US-20040122017-A1 MCH antagonists for the treatment of obesity SCHERING CORPORATION 2004-06-24 US disclosed
WO-2003047568-A1 N-ARYL-N'-ARYLCYCLOALKYL-UREA DERIVATIVES AS MCH ANTAGONISTS FOR THE TREATMENT OF OBESITY SCHERING CORPORATION (US) 2003-06-12 WO disclosed