SCHEMBL7516908

SCHEMBL7516908

CCCN(CCC)C1Cc2c[nH]c3ccc(C(=O)N(C)C)c(c23)C1

nearest known ligand 0.80

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 1/20 0.80
HTR1D P28221 8/20 0.54
HTR1B P28222 8/20 0.54
DRD2 P14416 2/20 0.54

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
SCHEMBL7512608 0.90 HTR1A (0.78) HTR1AHTR1DHTR1BDRD2
Ly-293284 SCHEMBL7204055 0.89 HTR1A (1.00) HTR1AHTR1DHTR1BDRD2
Ly-293284 SCHEMBL6902000 0.89 HTR1A (1.00) HTR1AHTR1DHTR1BDRD2
Ly-293284 SCHEMBL7202815 0.89 HTR1A (1.00) HTR1AHTR1DHTR1BDRD2
SCHEMBL8889776 0.89 HTR1A (0.83) HTR1AHTR1DHTR1BDRD2
SCHEMBL9412130 0.89 HTR1A (0.83) HTR1AHTR1DHTR1BDRD2
SCHEMBL6364891 0.88 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
SCHEMBL6765275 0.88 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
SCHEMBL7208944 0.88 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2
SCHEMBL8983347 0.88 HTR1A (0.81) HTR1AHTR1DHTR1BDRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0633023-A2 Preventing emesis and treating sexual dysfunction using tetrahydrobenz CD indole-6-carboxamides ELI LILLY AND COMPANY (US) 1995-01-11 EP claimed
EP-0392768-A1 Tetrahydrobenz[C,D] indole serotonin agonists ELI LILLY AND COMPANY (US) 1990-10-17 EP claimed
EP-1166783-A2 Tetrahydrobenz[CD]indole-6-carboxamides for treating sexual dysfunction ELI LILLY AND COMPANY (US) 2002-01-02 EP disclosed
EP-0633023-A2 Preventing emesis and treating sexual dysfunction using tetrahydrobenz CD indole-6-carboxamides ELI LILLY AND COMPANY (US) 1995-01-11 EP disclosed