SCHEMBL11095162

SCHEMBL11095162

NC(=O)C1(CCCN2CCCC2)C=CC=CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CYP1A2 P05177 1/20 0.36
MAPK1 P28482 1/20 0.36
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 3/20 0.32
HRH3 Q9Y5N1 3/20 0.32
HTR1A P08908 2/20 0.32
ADRA2A P08913 2/20 0.32
DRD1 P21728 2/20 0.32
SLC6A4 P31645 2/20 0.32
ADRA1A P35348 2/20 0.32
OPRM1 P35372 2/20 0.32
DRD3 P35462 2/20 0.32
SLC6A3 Q01959 2/20 0.32
KCNH2 Q12809 2/20 0.32
HTR7 P34969 2/20 0.32
MAPT P10636 3/20 0.31
CHRM2 P08172 1/20 0.31
CHRM1 P11229 1/20 0.31

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
SCHEMBL11093408 0.99 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2CYP1A2MAPK1ALDH1A1
SCHEMBL11089411 0.93 HRH3 (0.40) L3MBTL1SMN1; SMN2CYP1A2MAPK1ALDH1A1
SCHEMBL11086481 0.90 L3MBTL1 (0.41) L3MBTL1SMN1; SMN2CYP1A2MAPK1ALDH1A1
SCHEMBL11092055 0.89 PAOX (0.38) SMN1; SMN2ALDH1A1KDM4EHRH3DRD3
SCHEMBL11093762 0.88 HRH3 (0.33) SMN1; SMN2ALDH1A1HRH3POLBGAA
SCHEMBL11087785 0.87 SPHK1 (0.33) HRH3
SCHEMBL2780336 0.75 SPHK1 (0.33) CYP1A2KDM4EPOLB
SCHEMBL11097870 0.73 ALDH1A1 (0.30) SMN1; SMN2ALDH1A1MAPTPOLBTDP1
SCHEMBL11092967 0.71 NPSR1 (0.32)
SCHEMBL11088489 0.70

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
EP-0049779-B1 3-AMINOINDAZOLE DERIVATIVES AND PROCESS FOR PREPARATION THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1984-10-31 EP disclosed