SCHEMBL11301400

SCHEMBL11301400

O=C1O[C@H]2C=CCC[C@H]2C2C=CC=CC12

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
SCHEMBL11300171 1.00
SCHEMBL2049797 1.00
SCHEMBL10768180 0.71
SCHEMBL157367 0.68
SCHEMBL9387479 0.68
SCHEMBL11215030 0.68
SCHEMBL14373983 0.66
SCHEMBL11258439 0.65
SCHEMBL23796481 0.64
SCHEMBL20617897 0.64

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4131614-A Process for preparing cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-12-26 US claimed
EP-0004753-B1 PREPARATION OF TETRAHYDROBENZOXOCINS AND CIS-HEXAHYDRODIBENZOPYRANONES ELI LILLY AND COMPANY (US) 1982-05-26 EP disclosed
EP-0004753-A1 Preparation of tetrahydrobenzoxocins and cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1979-10-17 EP disclosed
EP-0004753-A1 Preparation of tetrahydrobenzoxocins and cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1979-10-17 EP disclosed
US-4171315-A Preparation of cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1979-10-16 US disclosed
US-4171315-A Preparation of cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1979-10-16 US disclosed
US-4148809-A Process for preparing dl-cis-1-hydroxy-3-substituted-6,6-dimethyl-6,6a,7,8,10,10a-hexahydro-9H-dibenzo[b,d]pyran-9-ones ELI LILLY AND COMPANY (US) 1979-04-10 US disclosed
US-4140701-A 2,6-Methano-2H-1-benzoxocins ELI LILLY AND COMPANY (US) 1979-02-20 US disclosed
US-4133816-A Preparation of cis-1-hydroxy-3-substituted-6,6-dimethyl-6,6a,7,8,10,10a-hexahydro-9H-dibenzo[b,d]pyran-9-ones and intermediates therefor ELI LILLY AND COMPANY (US) 1979-01-09 US disclosed
US-4131614-A Process for preparing cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-12-26 US disclosed
US-4131614-A Process for preparing cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-12-26 US disclosed
US-4131614-A Process for preparing cis-hexahydrodibenzopyranones ELI LILLY AND COMPANY (US) 1978-12-26 US disclosed
US-4115403-A Preparation of cis-1-hydroxy-3-substituted-6,6-dimethyl-6,6a,7,8,10,10a-hexahydro-9H-dibenzo [b,d]pyran-9-ones and intermediates therefor ELI LILLY AND COMPANY (US) 1978-09-19 US disclosed
US-4054582-A Process for converting cis-hexahydrodibenzo[b,d]pyran-9-ones to trans-hexahydrodibenzo[b,d]-pyran-9-ones ELI LILLY AND COMPANY (US) 1977-10-18 US disclosed
US-4054581-A Preparation of cis-1-hydroxy-3-substituted-6,6-dimethyl-6,6a,7,8,10,10a-hexahydro-9H-dibenzo[b,d]pyran-9-ones and intermediates therefor ELI LILLY AND COMPANY (US) 1977-10-18 US disclosed