SCHEMBL11446221

SCHEMBL11446221

NC(=O)c1ccc(N)cc1NCCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 10/20 0.61
▸ HTR1A P08908 7/20 0.54
▸ DRD2 P14416 4/20 0.50
▸ HTR2A P28223 3/20 0.50
▸ HTR6 P50406 3/20 0.50
▸ CACNA1G O43497 1/20 0.49
▸ DRD3 P35462 2/20 0.48
▸ FAAH O00519 1/20 0.48

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
SCHEMBL11457088 0.93 HTR7 (0.52) HTR7HTR1ADRD2HTR6CACNA1G
SCHEMBL11447385 0.91 HTR7 (0.61) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL11447049 0.89 HTR7 (0.61) HTR7HTR1ADRD2DRD3FAAH
SCHEMBL11447592 0.88 HTR7 (0.60) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL11447937 0.88 HTR7 (0.60) HTR7HTR1ADRD2DRD3
SCHEMBL11446686 0.88 HTR7 (0.64) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL11446577 0.87 HTR1A (0.61) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL11465485 0.87 HTR7 (0.54) HTR7HTR1ADRD2HTR2AHTR6
SCHEMBL11446907 0.86 GFER (0.60) HTR7HTR1ADRD2HTR2A
SCHEMBL11454667 0.85 HTR7 (0.59) HTR7HTR1ADRD2HTR2ADRD3

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
US-4205173-A 1-Heterocyclic alkyl-1,2,3,4-tetrahydroquinazolinones and analgesic intermediates thereof PENNWALT CORPORATION (US) 1980-05-27 — — US disclosed
US-4085107-A ANALGESICS PENNWALT CORPORATION (US) 1978-04-18 — — US disclosed
US-4060526-A 1-Heterocyclic alkyl-1,2,3,4-tetrahydroquinazolinones and analgesic intermediates thereof PENNWALT CORPORATION (US) 1977-11-29 — — US disclosed
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