SCHEMBL11465415

SCHEMBL11465415

NC(=O)c1ccccc1NCCN1CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 1/20 0.51
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
POLB P06746 2/20 0.49
PIM1 P11309 1/20 0.48
FLT3 P36888 1/20 0.48
PIM3 Q86V86 1/20 0.48
BRSK1 Q8TDC3 1/20 0.48
AURKB Q96GD4 1/20 0.48
MKNK2 Q9HBH9 1/20 0.48
HRH3 Q9Y5N1 1/20 0.48
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
NPC1 O15118 1/20 0.48
PARP1 P09874 3/20 0.47
MAPT P10636 1/20 0.46
CSF1R P07333 3/20 0.46
PARP2 Q9UGN5 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
SCHEMBL11454492 0.87 POLB (0.49) MEN1KMT2APOLBPIM1PIM3
SCHEMBL11465420 0.86 ALDH1A1 (0.66) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL11605251 0.86 KDM4E (0.46) MEN1KMT2APIM1FLT3PIM3
SCHEMBL11446935 0.86 KDM4E (0.46) DRD3MEN1KMT2APIM1FLT3
SCHEMBL4928911 0.85 ALDH1A1 (0.58) DRD3MEN1KMT2APOLBHRH3
SCHEMBL11448262 0.84 HTR1A (0.58) DRD3MEN1KMT2APOLB
SCHEMBL11605256 0.84 KMT2A (0.54) MEN1KMT2AALDH1A1MAPT
SCHEMBL11454827 0.84 SIRT2 (0.51) DRD3MEN1KMT2APOLBKDM4E
SCHEMBL11497813 0.84 ALDH1A1 (0.55) MEN1KMT2APOLBKDM4EALDH1A1
SCHEMBL4931903 0.83 ADRA1A (0.54) DRD3MEN1KMT2AHRH3KDM4E

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