SCHEMBL7415658

SCHEMBL7415658

CN(C)C1CCc2[nH]c3ccc(NC=O)cc3c2C1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR1F P30939 1/20 0.63
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
HTR1D P28221 7/20 0.42
HTR1B P28222 7/20 0.42
HTR1A P08908 1/20 0.42
BAZ2B Q9UIF8 1/20 0.38

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
Oxalic Acid SCHEMBL7543375 0.95 HTR1F (0.63) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL8647158 0.89 HTR1F (0.52) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL7409147 0.85 HTR1F (0.65) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL2323086 0.85 HTR1F (0.48) HTR1FKMT2AMEN1HTR1DHTR1B
Oxalic Acid SCHEMBL7541311 0.85 HTR1F (0.52) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL7026047 0.84 HTR1F (0.52) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL11334169 0.83 HTR1F (0.74) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL2301469 0.82 HTR1B (0.61) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL7031093 0.82 HTR1B (0.61) HTR1FKMT2AMEN1HTR1DHTR1B
SCHEMBL980209 0.82 HTR1B (0.61) HTR1FKMT2AMEN1HTR1DHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0603432-B1 Tetrahydrocarbazole derivatives for the manufacture of a medicament for the treatment of a disease where a 5-HT1-like agonist is indicated SMITHKLINE BEECHAM PLC (GB) 1998-10-21 EP claimed
EP-0591280-B1 USE OF TETRAHYDROCARBAZOLE DERIVATIVES AS 5HT1-RECEPTOR AGONISTS SMITHKLINE BEECHAM PLC (GB) 1998-09-09 EP claimed
EP-0603432-A1 Tetrahydrocarbazole derivatives for the manufacture of a medicament for the treatment of a disease where a 5-HT1-like agonist is indicated SMITHKLINE BEECHAM PLC (GB) 1994-06-29 EP claimed
US-4257952-A PSYCHOTROPIC DRUGS, ANALGESICS, ANTIHISTAMINES STERLING DRUG INC. (US) 1981-03-24 US disclosed
US-4172834-A ANALGESICS, ANTIHISTAMINES AND PSYCHOTROPIC AGENTS STERLING DRUG INC. (US) 1979-10-30 US disclosed
US-4062864-A ANALGESIC, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1977-12-13 US disclosed
US-3959309-A ANALGESICS, PSYCHOTROPIC, ANTIHISTAMINE STERLING DRUG INC. (US) 1976-05-25 US disclosed