SCHEMBL7008481

SCHEMBL7008481

CN1CCC(c2c[nH]c3ccc(NC(=O)c4ccccc4)nc23)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR1A P08908 20/20 1.00
HTR1F P30939 20/20 1.00
HTR1B P28222 17/20 1.00
HTR1D P28221 15/20 1.00
HTR2A P28223 1/20 0.81
HTR2C P28335 1/20 0.81
HTR1E P28566 1/20 0.81
HTR4 Q13639 1/20 0.81

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
SCHEMBL7013190 0.91 HTR1F (1.00) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7010256 0.91 HTR1F (1.00) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7011642 0.90 HTR1F (0.83) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7008940 0.90 HTR1F (0.83) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7011623 0.90 HTR1F (1.00) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7015529 0.89 HTR1A (0.80) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7007762 0.89 HTR1A (1.00) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7009197 0.89 HTR1F (0.82) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7011970 0.89 HTR1F (0.82) HTR1AHTR1FHTR1BHTR1DHTR2A
SCHEMBL7009539 0.89 HTR1F (0.82) HTR1AHTR1FHTR1BHTR1DHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0842934-B1 5-HT1F agonists LILLY CO ELI (US) 2003-10-29 EP disclosed
EP-1267802-A2 LEAVE-IN HAIR COSMETIC COMPOSITIONS FOR ENHANCING VOLUME CONTAINING MICROSPHERES THE PROCTER & GAMBLE COMPANY (US) 2003-01-02 EP disclosed
EP-1267805-A2 LEAVE-IN HAIR COSMETIC COMPOSITIONS FOR ENHANCING VOLUME THE PROCTER & GAMBLE COMPANY (US) 2003-01-02 EP disclosed
WO-2001074311-A2 LEAVE-IN HAIR COSMETIC COMPOSITIONS FOR ENHANCING VOLUME THE PROCTER & GAMBLE COMPANY (US) 2001-10-11 WO disclosed
WO-2001074309-A1 HAIR CONDITIONING COMPOSITION COMPRISING CARBOXYLIC ACID/CARBOXYLATE COPOLYMER AND VINYLPYRROLIDONE COPOLYMER THE PROCTER & GAMBLE COMPANY (US) 2001-10-11 WO disclosed
WO-2001074310-A2 LEAVE-IN HAIR COSMETIC COMPOSITIONS FOR ENHANCING VOLUME CONTAINING MICROSPHERES THE PROCTER & GAMBLE COMPANY (US) 2001-10-11 WO disclosed
WO-2001074312-A2 HAIR CONDITIONING COMPOSITION COMPRISING VINYLPYRROLIDONE COPOLYMER THE PROCTER & GAMBLE COMPANY (US) 2001-10-11 WO disclosed
EP-1082958-A2 5-HT1F agonists in chronic pain ELI LILLY AND COMPANY (US) 2001-03-14 EP disclosed
US-5998622-A ANALGESICS; ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION ELI LILLY AND COMPANY (US) 1999-12-07 US disclosed
EP-0842934-A1 5-HT1F agonists ELI LILLY AND COMPANY (US) 1998-05-20 EP disclosed