SCHEMBL11446242

SCHEMBL11446242

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

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 2/20 0.47
▸ POLB P06746 1/20 0.44
▸ GFER P55789 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTR1A P08908 1/20 0.43
▸ DRD3 P35462 1/20 0.43
▸ CACNA1G O43497 1/20 0.43
▸ DRD4 P21917 1/20 0.43
▸ MAPT P10636 1/20 0.43

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
SCHEMBL11465300 0.92 HTR7 (0.47) HTR7POLBGFERHSD17B10KMT2A
SCHEMBL11454852 0.88 HTR7 (0.56) HTR7POLBGFERHSD17B10DRD4
SCHEMBL11447087 0.88 HTR7 (0.51) HTR7POLBGFERHSD17B10KMT2A
SCHEMBL11447099 0.87 HTR7 (0.52) HTR7POLBGFERHSD17B10KMT2A
SCHEMBL11456795 0.87 POLB (0.52) HTR7POLBGFERKMT2AMEN1
SCHEMBL11446750 0.86 POLB (0.47) HTR7POLBGFERHSD17B10KMT2A
SCHEMBL11448339 0.86 HTR6 (0.54) HTR7POLBGFERKMT2AMEN1
Hydrochloric Acid SCHEMBL11447560 0.86 HTR7 (0.51) HTR7POLBGFERHSD17B10KMT2A
SCHEMBL11446172 0.86 DRD4 (0.56) HTR7POLBGFERKMT2AMEN1
SCHEMBL11446759 0.83 HTR7 (0.47) HTR7POLBGFERHSD17B10KMT2A

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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