SCHEMBL6157847

SCHEMBL6157847

O=C1Nc2cccc3c2C1(CCCCN1CCC(c2ccccc2)CC1)CCC3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 20/20 1.00
HTR2A P28223 2/20 0.68
HTR2C P28335 2/20 0.68
HTR2B P41595 2/20 0.68
HTR1A P08908 2/20 0.66
HTR6 P50406 1/20 0.66
DRD2 P14416 1/20 0.66

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
SCHEMBL6421130 0.87 HTR7 (0.76) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL6160438 0.85 HTR7 (0.73) HTR7HTR2AHTR2CHTR2B
SCHEMBL6421219 0.84 HTR7 (0.78) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL6157306 0.84 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL6422098 0.84 HTR7 (0.72) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL6157667 0.83 HTR7 (1.00) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL6160460 0.83 HTR7 (0.79) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL6424392 0.83 HTR7 (0.71) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL7614260 0.83 HTR7 (0.76) HTR7HTR2AHTR2CHTR2BHTR1A
SCHEMBL6422243 0.82 HTR7 (0.75) HTR7HTR2AHTR2CHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0937715-B1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA (JP) 2005-06-01 EP disclosed
US-6355642-B1 PSYCHOLOGICAL DISORDERS AND BRAIN DISORDERS MEIJI SEIKA KAISHA, LTD. (JP) 2002-03-12 US disclosed
EP-0937715-A1 TETRAHYDROBENZINDOLE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1999-08-25 EP disclosed