SCHEMBL8788586

SCHEMBL8788586

CC(=O)Nc1ccc2[nH]cc(C[C@H]3CCCN3C)c2c1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 8/20 0.65
HTR1D P28221 6/20 0.65
HTR6 P50406 13/20 0.65
HTR1A P08908 3/20 0.62
HTR2A P28223 1/20 0.61
HTR2C P28335 1/20 0.61
HTR1F P30939 1/20 0.61
HTR7 P34969 1/20 0.61

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
SCHEMBL8788591 1.00 HTR1B (0.65) HTR1BHTR1DHTR6HTR1AHTR2A
SCHEMBL8791154 0.89 HTR6 (0.62) HTR1BHTR1DHTR6HTR1AHTR2A
SCHEMBL8790836 0.88 HTR6 (0.64) HTR1BHTR1DHTR6HTR1A
SCHEMBL8790828 0.88 HTR6 (0.64) HTR1BHTR1DHTR6HTR1A
SCHEMBL8119548 0.86 HTR1B (0.64) HTR1BHTR1DHTR6HTR1A
SCHEMBL8914362 0.86 HTR1B (0.69) HTR1BHTR1DHTR6HTR1A
SCHEMBL27327364 0.84 HTR6 (0.62) HTR1BHTR1DHTR6HTR1AHTR2A
SCHEMBL27293301 0.84 HTR1B (0.67) HTR1BHTR1DHTR6HTR1AHTR2A
SCHEMBL8789827 0.84 HTR1B (0.67) HTR1BHTR1DHTR6HTR1AHTR2A
SCHEMBL8789833 0.84 HTR1B (0.67) HTR1BHTR1DHTR6HTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0592438-B1 INDOLE DERIVATIVES PFIZER (US) 1997-08-27 EP disclosed
US-5607951-A SEROTONIN AGONIST FOR NERVOUS SYSTEM DISORDERS, ANALGESICS AND PSYCHOTHERAPEUTICS PFIZER INC (US) 1997-03-04 US disclosed
US-5578612-A Indole derivatives PFIZER INC. (US) 1996-11-26 US disclosed
US-5559129-A SEROTONIN (5HT1) ANTAGONIST FOR TREATMENT OF DEPRESSION, ANXIETY, EATING DISORDERS, OBESITY, DRUG ABUSE, HEADACHES, AND PAIN PFIZER INC (US) 1996-09-24 US disclosed
US-5559246-A PROCESS OF DEHYDROHALOGENATION FOR CYCLIZATION TO PRODUCE PSYCHOTHERAPEUTIC AGENTS AND ANTISEROTONIN ANTAGONIST PFIZER INC. (US) 1996-09-24 US disclosed
US-5545644-A SEROTONIN AGONISTS; HYPOTENSIVE AND ANXIOLYTIC AGENTS; ANALGESICS; ANTIDEPRESSANTS; EATING DISORDERS; DRUG ABUSE; HEADACHES; VASCULAR DISORDERS PFIZER INC. (US) 1996-08-13 US disclosed
EP-0592438-A1 INDOLE DERIVATIVES. PFIZER (US) 1994-04-20 EP disclosed
WO-1992006973-A1 INDOLE DERIVATIVES PFIZER INC. (US) 1992-04-30 WO disclosed