SCHEMBL11454852

SCHEMBL11454852

CN(C)C(=O)c1cc(O)ccc1NCCN1CCN(c2ccccc2)CC1

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 8/20 0.56
▸ DRD4 P21917 1/20 0.46
▸ 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
SCHEMBL11446591 0.92 HTR7 (0.56) HTR7POLBGFERHSD17B10
SCHEMBL11446172 0.89 DRD4 (0.56) HTR7DRD4POLBGFER
SCHEMBL11446242 0.88 HTR7 (0.47) HTR7DRD4POLBGFERHSD17B10
SCHEMBL11456795 0.88 POLB (0.52) HTR7DRD4POLBGFER
SCHEMBL11466045 0.88 HTR7 (0.61) HTR7DRD4POLBGFERHSD17B10
SCHEMBL11446743 0.86 HTR7 (0.57) HTR7DRD4POLBGFERHSD17B10
SCHEMBL11500563 0.86 HTR7 (0.57) HTR7DRD4POLBGFER
SCHEMBL11457535 0.86 HTR7 (0.59) HTR7DRD4
SCHEMBL11454261 0.83 HTR7 (0.56) HTR7DRD4
SCHEMBL11456788 0.83 HTR7 (0.55) HTR7DRD4POLBGFERHSD17B10

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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