SCHEMBL1048005

SCHEMBL1048005

CCCCN1CCN(C(=O)O)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR183 P32249 1/20 0.47
CHRM3 P20309 1/20 0.43
KDM4E B2RXH2 2/20 0.42
ALDH1A1 P00352 2/20 0.42
USP2 O75604 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
GNAI3 P08754 1/20 0.42
GNAO1 P09471 1/20 0.42
GNAI1 P63096 1/20 0.42
S1PR1 P21453 1/20 0.41
S1PR3 Q99500 1/20 0.41
S1PR5 Q9H228 1/20 0.41
HRH2 P25021 2/20 0.41
HRH1 P35367 2/20 0.41
PAOX Q6QHF9 1/20 0.40
NPC1 O15118 1/20 0.40
KCNH2 Q12809 1/20 0.40
CYP1A2 P05177 1/20 0.39
MAPK1 P28482 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL29086855 0.92 GNAI3 (0.53) CHRM3GNAI3GNAO1GNAI1S1PR1
SCHEMBL4319439 0.87 HRH3 (0.47) KDM4EALDH1A1TDP1SMN1; SMN2
SCHEMBL2527190 0.83 S1PR1 (0.46) CHRM3ALDH1A1S1PR1S1PR3S1PR5
SCHEMBL3316196 0.83 GNAI3 (0.53) CHRM3KDM4EALDH1A1GNAI3GNAO1
SCHEMBL4910227 0.83 CYP1A2 (0.52) GPR183KDM4EALDH1A1USP2TDP1
SCHEMBL24773181 0.82 HRH2 (0.53) GPR183ALDH1A1USP2TDP1GNAI3
SCHEMBL4910222 0.82 GPR183 (0.46) GPR183CHRM3KDM4EALDH1A1USP2
SCHEMBL27318089 0.82 GNAI3 (0.46) GPR183CHRM3USP2GNAI3GNAO1
SCHEMBL705057 0.81 CYP1A2 (0.41) PAOXCYP1A2MAPK1SMN1; SMN2
SCHEMBL16335347 0.81 SMN1; SMN2 (0.55) KDM4EALDH1A1CYP1A2MAPK1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1602191-A Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2005-03-30 CN claimed
WO-2011005052-A2 NOVEL ARYLPIPERAZINE-CONTAINING IMIDAZOLE 4-CARBOXAMIDE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME GREEN GROSS CORPORATION (KR) 2011-01-13 WO disclosed
CN-1326519-C Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2007-07-18 CN disclosed
CN-1602191-A Compounds and uses thereof for decreasing activity of hormone-sensitive lipase NOVO NORDISK AS (DK) 2005-03-30 CN disclosed