SCHEMBL6829549

SCHEMBL6829549

O=C(O)c1ccccc1N1CCC(Cl)CC1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 3/20 0.51
ALDH1A1 P00352 4/20 0.48
ALOX15 P16050 1/20 0.48
HRH1 P35367 1/20 0.48
CCR3 P51677 1/20 0.48
KCNH2 Q12809 1/20 0.48
ENPP2 Q13822 2/20 0.48
L3MBTL1 Q9Y468 2/20 0.48
GAA P10253 1/20 0.48
CPB1 P15086 1/20 0.48
NPC1 O15118 1/20 0.47
PTPN1 P18031 1/20 0.47
MYC P01106 3/20 0.46
NR4A1 P22736 1/20 0.46
POLB P06746 1/20 0.44
APEX1 P27695 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL15533384 0.86 ALDH1A1 (0.48) NOTUMALDH1A1ALOX15HRH1CCR3
SCHEMBL27676401 0.86 ALDH1A1 (0.48) NOTUMALDH1A1ALOX15HRH1CCR3
SCHEMBL8048603 0.85 ALDH1A1 (0.61) ALDH1A1ALOX15ENPP2L3MBTL1NPC1
SCHEMBL6650052 0.85 KMT2A (0.60) ALDH1A1ALOX15L3MBTL1GAANPC1
SCHEMBL29467270 0.82 NPC1 (0.68) ALDH1A1ALOX15ENPP2L3MBTL1GAA
SCHEMBL2492855 0.82 NPC1 (0.68) ALDH1A1ALOX15ENPP2L3MBTL1GAA
SCHEMBL6828683 0.81 HRH1 (0.50) ALDH1A1ALOX15HRH1CCR3KCNH2
SCHEMBL14528966 0.81 L3MBTL3 (0.59) L3MBTL1NPC1PTPN1TDP1
SCHEMBL1664012 0.81 TSHR (0.58) ALDH1A1ENPP2NPC1MYCTDP1
SCHEMBL17893580 0.81 ALDH1A1 (0.50) ALDH1A1ALOX15ENPP2L3MBTL1GAA

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004039795-A2 AMIDE COMPOUNDS FOR THE TREATMENT OF HYPERLIPIDEMIA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 WO disclosed