SCHEMBL11446591

SCHEMBL11446591

CN(C)C(=O)c1ccc(O)cc1NCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 9/20 0.56
▸ HTR6 P50406 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ HSD17B10 Q99714 1/20 0.45

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
SCHEMBL11454852 0.92 HTR7 (0.56) HTR7POLBGFERHSD17B10
SCHEMBL11465300 0.88 HTR7 (0.47) HTR7HTR6POLBGFERHSD17B10
SCHEMBL11447319 0.88 HTR7 (0.61) HTR7HTR6POLBGFERHSD17B10
SCHEMBL11456795 0.88 POLB (0.52) HTR7POLBGFER
SCHEMBL11465720 0.87 HTR6 (0.60) HTR7HTR6POLBGFER
SCHEMBL11456872 0.87 GFER (0.56) HTR7HTR6POLBGFER
SCHEMBL11446975 0.86 HTR7 (0.57) HTR7HTR6POLBGFERHSD17B10
SCHEMBL11446863 0.86 HTR7 (0.59) HTR7HTR6
SCHEMBL11465177 0.83 HTR7 (0.56) HTR7
SCHEMBL11456788 0.83 HTR7 (0.55) HTR7POLBGFERHSD17B10

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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