SCHEMBL366173

SCHEMBL366173

COC(=O)c1c2ccccc2n2cc(C(=O)CN3CCOCC3)ccc12

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.47
ALDH1A1 P00352 4/20 0.47
HTT P42858 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
TSHR P16473 2/20 0.45
POLB P06746 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
ALOX15 P16050 1/20 0.43

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
SCHEMBL365335 0.84 CNR2 (0.47) CNR1ALDH1A1MEN1KMT2APOLB
SCHEMBL366172 0.84 ALDH1A1 (0.47) CNR1ALDH1A1HTTMAPTMEN1
SCHEMBL365030 0.81 NR4A2 (0.48) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL366338 0.81 NR4A2 (0.45) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL364927 0.79 SRC (0.51) ALDH1A1MAPTMEN1KMT2ATSHR
SCHEMBL366941 0.77 ALDH1A1 (0.46) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL364339 0.77 KMT2A (0.49) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL364281 0.77 NR4A2 (0.48) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL367527 0.76 NR4A2 (0.41) ALDH1A1MAPTMEN1KMT2APOLB
SCHEMBL366111 0.76 LMNA (0.52) ALDH1A1MAPTMEN1KMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO claimed
WO-2012007007-A1 INHIBITORS OF HDME EPITHERAPEUTICS APS (DK) 2012-01-19 WO disclosed