SCHEMBL6158352

SCHEMBL6158352

O=C1Nc2cccc3c2C1(CCCCN1CCN(c2ncccn2)CC1)CCC3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 20/20 1.00
HTR2A P28223 1/20 0.71
HTR2C P28335 1/20 0.71
HTR2B P41595 1/20 0.71

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
SCHEMBL6157127 0.90 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL6157306 0.86 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL6157795 0.86 HTR7 (0.80) HTR7HTR2AHTR2CHTR2B
SCHEMBL6161449 0.84 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL6160848 0.84 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL6158853 0.83 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL7664123 0.83 HTR7 (0.82) HTR7HTR2AHTR2CHTR2B
SCHEMBL6159368 0.83 HTR7 (1.00) HTR7HTR2AHTR2CHTR2B
SCHEMBL7612489 0.82 HTR7 (0.69) HTR7HTR2AHTR2CHTR2B
SCHEMBL6421219 0.82 HTR7 (0.78) 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