SCHEMBL7876360

SCHEMBL7876360

Cc1cccc2c(C3CCN(C[C@H](O)COc4cccc5[nH]ccc45)CC3)c[nH]c12

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 20/20 0.67
SLC6A4 P31645 4/20 0.60

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
SCHEMBL8695897 1.00 HTR1A (0.67) HTR1ASLC6A4
SCHEMBL8692932 0.90 HTR1A (0.67) HTR1ASLC6A4
SCHEMBL7885523 0.90 HTR1A (0.67) HTR1ASLC6A4
SCHEMBL8690072 0.86 HTR1A (0.62) HTR1ASLC6A4
SCHEMBL7885541 0.86 HTR1A (0.62) HTR1ASLC6A4
SCHEMBL8696680 0.85 HTR1A (0.69) HTR1ASLC6A4
SCHEMBL7882958 0.85 HTR1A (0.69) HTR1ASLC6A4
Hydrochloric Acid SCHEMBL11015770 0.83 LMNA (0.64) HTR1ASLC6A4
SCHEMBL7881135 0.83 HTR1A (0.70) HTR1ASLC6A4
SCHEMBL8693419 0.83 HTR1A (0.70) HTR1ASLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172073-B1 BENZIMIDAZOLYLOXY ALKANAMINES AS SEROTONIN REUPTAKE INHIBITORS; NICOTINE AND TOBACCO WITHDRAWAL; PSYCHOLOGICAL, EATING, BRAIN, GASTROINTESTINAL, SLEEP, AND SEXUAL DISORDERS ELI LILLY AND COMPANY 2001-01-09 US disclosed
US-5627196-A ANTIDEPRESSANTS AND ANTISEROTONIN AGENTS ELI LILLY AND COMPANY (US) 1997-05-06 US disclosed
US-5614523-A INDOLYLOXY COMPOUNDS ELI LILLY AND COMPANY (US) 1997-03-25 US disclosed
US-5576321-A ALKOXY-SUBSTITUTED INDOLES ELI LILLY AND COMPANY (US) 1996-11-19 US disclosed
WO-1996022290-A1 COMPOUNDS HAVING EFFECTS ON SEROTONIN-RELATED SYSTEMS ELI LILLY AND COMPANY (US) 1996-07-25 WO disclosed
EP-0722941-A2 Compounds having effects on serotonin-related systems ELI LILLY AND COMPANY (US) 1996-07-24 EP disclosed