SCHEMBL7832589

SCHEMBL7832589

c1ccc2c(c1)CCc1ccccc1N2CC1CNCCO1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SLC6A2 P23975 15/20 0.51
▸ SLC6A3 Q01959 9/20 0.51
▸ SLC6A4 P31645 11/20 0.45
▸ HTR2B P41595 2/20 0.43
▸ HTR2A P28223 2/20 0.43
▸ ADRB2 P07550 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ ADRA2C P18825 1/20 0.43
▸ HTR2C P28335 1/20 0.40

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
SCHEMBL11681069 0.89 SLC6A2 (0.46) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
SCHEMBL11679389 0.87 SLC6A2 (0.42) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
SCHEMBL11679397 0.87 GRIN1 (0.44) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
SCHEMBL11678040 0.86 SLC6A2 (0.48) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
Maleic Acid SCHEMBL9615196 0.83 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4
Fumaric Acid SCHEMBL9615197 0.83 SLC6A2 (0.45) SLC6A2SLC6A3SLC6A4
SCHEMBL11679858 0.83 SLC6A2 (0.51) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
SCHEMBL11677994 0.81 SLC6A2 (0.49) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
SCHEMBL7167351 0.78 HTR2A (0.47) SLC6A2SLC6A3SLC6A4HTR2BHTR2A
SCHEMBL14707008 0.78 HTR2A (0.47) SLC6A2SLC6A3SLC6A4HTR2BHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6214816-B1 ANTIDIABETIC AGENTS, ANALGESICS AND ANTIINFLAMMATORY AGENTS NOVO NORDISK A/S (DK) 2001-04-10 — — US disclosed
EP-1071679-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 2001-01-31 — — EP disclosed
WO-1999047517-A1 NOVEL HETEROCYCLIC COMPOUNDS NOVO NORDISK A/S (DK) 1999-09-23 — — WO disclosed
US-4017621-A 2-Morpholinyl tricyclic dibenzazepine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-04-12 — — US disclosed
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