SCHEMBL7835596

SCHEMBL7835596

CCCOc1cccc2ccc(C)cc12

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.50
CYP1A2 P05177 1/20 0.50
HTR1B P28222 11/20 0.49
MCHR1 Q99705 1/20 0.49
HTR1D P28221 3/20 0.48
CNR1 P21554 1/20 0.47
CNR2 P34972 1/20 0.47
SLC6A4 P31645 2/20 0.44
HRH1 P35367 1/20 0.44
MCL1 Q07820 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
Ammonia Solution, Strong SCHEMBL27919268 0.98 CYP2A6 (0.49) CYP2A6CYP1A2HTR1BMCHR1HTR1D
Ammonia Solution, Strong SCHEMBL27937794 0.85 CYP1A2 (0.49) CYP2A6CYP1A2HTR1BMCHR1HTR1D
SCHEMBL15772531 0.83 MTNR1A (0.52) HTR1BMCHR1HTR1DCNR1CNR2
SCHEMBL15473247 0.83 HTR1B (0.49) CYP2A6HTR1BMCHR1HTR1DCNR1
SCHEMBL7835592 0.82 HTR1B (0.48) CYP2A6HTR1BMCHR1HTR1DCNR1
SCHEMBL8018172 0.81 CYP1A2 (0.52) CYP2A6CYP1A2HTR1BHTR1DSLC6A4
SCHEMBL15473235 0.81 MTNR1A (0.51) CYP2A6CYP1A2HTR1BMCHR1HTR1D
SCHEMBL2116954 0.80 HTR1B (0.70) HTR1BHTR1DCNR1CNR2SLC6A4
SCHEMBL30209610 0.80 HTR1B (0.70) HTR1BHTR1DCNR1CNR2SLC6A4
SCHEMBL18053268 0.80 CYP2A6 (0.50) CYP2A6CYP1A2HTR1BHTR1DSLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0676398-B1 Heterocyclic compounds having anti-diabetic activity, their preparation and their use SANKYO CO (JP) 2001-10-24 EP disclosed
US-6117893-A Heterocyclic compounds having anti-diabetic activity and their use SANKYO COMPANY, LIMITED (JP) 2000-09-12 US disclosed
EP-1022274-A1 Oxazolidinedione and Thiazolidinedione derivatves, their preparation and their use Sankyo Company Limited (JP) 2000-07-26 EP disclosed
US-5977365-A HYPOGLYCEMIC AGENTS SANKYO COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5962470-A Heterocyclic compounds having anti-diabetic activity and their use SANKYO COMPANY, LIMITED (JP) 1999-10-05 US disclosed
US-5886014-A TREATMENT AND/OR PROPHYLAXIS OF A VARIETY OF DISORDERS, INCLUDING HYPERLIPEMIA, HYPERGLYCEMIA, OBESITY, IMPAIRED GLUCOSE TOLERANCE (IGT), INSULIN RESISTANCE AND DIABETIC COMPLICATIONS SANKYO COMPANY, LIMITED (JP) 1999-03-23 US disclosed
US-5834501-A TREATING DIABETES OR HYPERLIPEMIA SANKYO COMPANY, LIMITED (JP) 1998-11-10 US disclosed
US-5739345-A HYPOGLYCEMIC AND ANTIDIABETIC AGENTS SANKYO COMPANY, LIMITED (JP) 1998-04-14 US disclosed
US-5624935-A ANTIDIABETIC AGENTS, HYPOGLYCEMIC AGENTS OR ANTILIPEMIC AGENTS SANKYO COMPANY, LIMITED 1997-04-29 US disclosed
EP-0745600-A1 Benzimidazole derivatives, their preparation and their therapeutic use SANKYO COMPANY LIMITED (JP) 1996-12-04 EP disclosed
EP-0676398-A2 Heterocyclic compounds having anti-diabetic activity, their preparation and their use SANKYO COMPANY LIMITED (JP) 1995-10-11 EP disclosed