SCHEMBL8933294

SCHEMBL8933294

NC(Cc1ccc2ccccc2c1)c1nnnn1CCc1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
SLC6A2 P23975 5/20 0.45
SLC6A4 P31645 5/20 0.45
SLC6A3 Q01959 5/20 0.45
GAA P10253 1/20 0.44
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
HTR2B P41595 1/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
POLB P06746 2/20 0.42
SLC1A2 P43004 3/20 0.42
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
NPSR1 Q6W5P4 3/20 0.41
HTT P42858 2/20 0.41
TSHR P16473 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ATM Q13315 1/20 0.41
SLC1A3 P43003 1/20 0.41

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
SCHEMBL6601160 1.00 ALDH1A1 (0.45) ALDH1A1SLC6A2SLC6A4SLC6A3GAA
SCHEMBL6600462 0.81 TACR1 (0.46) ALDH1A1GAAMEN1KMT2APOLB
SCHEMBL27478599 0.74 HDAC3 (0.41) SLC6A4HTR2AHTR2CHTR2BSLC1A2
SCHEMBL27478598 0.74 HDAC3 (0.41) SLC6A4HTR2AHTR2CHTR2BSLC1A2
SCHEMBL6600601 0.74 GHSR (0.51) ALDH1A1MEN1KMT2APOLBLMNA
SCHEMBL7541164 0.73 CNR2 (0.43) ALDH1A1SLC6A2SLC6A4SLC6A3GAA
SCHEMBL4505335 0.71 ALDH1A1 (0.40) ALDH1A1SLC6A2SLC6A4SLC6A3GAA
SCHEMBL3703216 0.69 GHSR (0.46) SLC6A2SLC6A4SLC6A3LMNANPSR1
SCHEMBL3703214 0.69 GHSR (0.46) SLC6A2SLC6A4SLC6A3LMNANPSR1
SCHEMBL3707997 0.69 GHSR (0.46) SLC6A2SLC6A4SLC6A3LMNANPSR1

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-1996022997-A1 COMPOUNDS WITH GROWTH HORMONE RELEASING PROPERTIES NOVO NORDISK A/S (DK) 1996-08-01 WO disclosed