SCHEMBL517405

SCHEMBL517405

C1=C/C2=C/C=c3/cccc/c3=C/NC2C=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
SCHEMBL15800558 0.67
SCHEMBL9212606 0.64
SCHEMBL9212445 0.62
SCHEMBL11035106 0.60
SCHEMBL9702349 0.60
SCHEMBL5888763 0.59
SCHEMBL26612937 0.59 ALOX12 (0.39)
SCHEMBL17104877 0.58
SCHEMBL1385588 0.58
SCHEMBL13716235 0.57

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8039474-B2 2,3,4,9-tetrahydro-1H-carbazole derivatives as CRTH2 receptor antagonists ACTELION PHARMACEUTICAL LTD. (CH) 2011-10-18 US claimed
EP-1833791-B1 2,3,4,9-TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-08-03 EP claimed
US-20090270414-A1 2,3,4,9- TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2009-10-29 US claimed
US-RE47539-E1 Aza-dibenzocyclooctynes and methods of making and using same UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2019-07-30 US disclosed
US-8912322-B2 Aza-dibenzocyclooctynes and methods of making and using same UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. (US) 2014-12-16 US disclosed
US-20120197012-A9 AZA-DIBENZOCYCLOOCTYNES AND METHODS OF MAKING AND USING SAME UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2012-08-02 US disclosed
US-20120029186-A1 AZA-DIBENZOCYCLOOCTYNES AND METHODS OF MAKING AND USING SAME UNIVERSITY OF GEORGIA RESEARCH FOUNDATION, INC. 2012-02-02 US disclosed
US-8039474-B2 2,3,4,9-tetrahydro-1H-carbazole derivatives as CRTH2 receptor antagonists ACTELION PHARMACEUTICAL LTD. (CH) 2011-10-18 US disclosed
EP-1833791-B1 2,3,4,9-TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2011-08-03 EP disclosed
US-20090270414-A1 2,3,4,9- TETRAHYDRO-1H-CARBAZOLE DERIVATIVES AS CRTH2 RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2009-10-29 US disclosed
US-7417040-B2 Fused tricyclic compounds as inhibitors of 17β-hydroxysteroid dehydrogenase 3 BRISTOL-MYERS SQUIBB COMPANY (US) 2008-08-26 US disclosed
US-20050250753-A1 Fused tricyclic compounds as inhibitors of 17beta-hydroxysteroid dehydrogenase 3 BRISTOL-MYERS SQUIBB COMPANY 2005-11-10 US disclosed