SCHEMBL28207096

SCHEMBL28207096

COc1ccc(-n2c(NCCCN3CCOCC3)nc3ccccc3c2=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 1/20 0.59
▸ POLB P06746 4/20 0.54
▸ LMNA P02545 2/20 0.54
▸ KDM4E B2RXH2 2/20 0.54
▸ NPC1 O15118 1/20 0.54
▸ GLA P06280 1/20 0.54
▸ GAA P10253 1/20 0.54
▸ RAD52 P43351 1/20 0.54
▸ RAB9A P51151 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ HTR7 P34969 2/20 0.54
▸ RXFP1 Q9HBX9 2/20 0.52
▸ HSD17B10 Q99714 3/20 0.51
▸ USP2 O75604 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP3A4 P08684 1/20 0.51
▸ CYP2D6 P10635 1/20 0.51
▸ CYP2C19 P33261 1/20 0.51
▸ CLK4 Q9HAZ1 1/20 0.51

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
SCHEMBL28551149 0.90 KDM4E (0.63) FLT3POLBLMNAKDM4ENPC1
SCHEMBL28537294 0.90 KMT2A (0.57) POLBLMNAKDM4ENPC1GLA
SCHEMBL28207090 0.89 NME2 (0.54) POLBLMNAKDM4ENPC1GLA
SCHEMBL28207630 0.88 KMT2A (0.57) FLT3POLBLMNAKDM4ENPC1
SCHEMBL28541749 0.88 MAPK1 (0.60) POLBLMNAKDM4ENPC1GLA
SCHEMBL28207162 0.88 POLB (0.57) FLT3POLBLMNAKDM4ENPC1
SCHEMBL28207093 0.86 KDM4E (0.55) POLBLMNAKDM4ENPC1GLA
SCHEMBL28207160 0.86 KMT2A (0.55) FLT3POLBLMNAKDM4ENPC1
SCHEMBL28550284 0.83 KMT2A (0.58) POLBLMNAKDM4ENPC1GLA
SCHEMBL28955063 0.79 KDM4E (0.56) FLT3POLBLMNAKDM4ENPC1

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
CN-107868060-B 2- [3- (4-morpholinyl) propylamino ] -3-aryl-4-quinolinone compounds and application thereof 沈阳药科大学 2021-04-09 — — CN claimed
CN-107868060-B 2- [3- (4-morpholinyl) propylamino ] -3-aryl-4-quinolinone compounds and application thereof 沈阳药科大学 2021-04-09 — — CN disclosed
CN-107868060-A The quinolinones compound of 2 [3 (4 morpholinyl) Propylamino] 3 aryl 4 and its application 沈阳药科大学 2018-04-03 — — CN disclosed
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