SCHEMBL25601967

SCHEMBL25601967

CC(=O)CCC(=O)Nc1ccc2c(c1)Cc1cc(Br)ccc1-2

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.63
SLC1A3 P43003 4/20 0.62
SLC1A2 P43004 4/20 0.62
SLC1A1 P43005 4/20 0.62
RAB9A P51151 3/20 0.61
NPC1 O15118 2/20 0.56
CYP1A2 P05177 1/20 0.51
ADRA2A P08913 1/20 0.51
MAOA P21397 1/20 0.51
SLC6A2 P23975 1/20 0.51
HTR2C P28335 1/20 0.51
SLC6A4 P31645 1/20 0.51
HTR2B P41595 1/20 0.51
KMT2A Q03164 4/20 0.50
HPGD P15428 1/20 0.47
MEN1 O00255 3/20 0.46
MAPT P10636 2/20 0.45
KDM4E B2RXH2 1/20 0.45
CA12 O43570 1/20 0.45
CA1 P00915 1/20 0.45

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
SCHEMBL25601954 0.86 POLB (0.63) POLBSLC1A3SLC1A2SLC1A1RAB9A
SCHEMBL7932191 0.83 SLC1A3 (0.65) POLBSLC1A3SLC1A2SLC1A1RAB9A
SCHEMBL6329814 0.79 HPGD (0.70) POLBRAB9ANPC1KMT2AHPGD
SCHEMBL22079053 0.76 RAB9A (0.55) POLBSLC1A3SLC1A2SLC1A1RAB9A
SCHEMBL21765666 0.76 RAB9A (0.71) POLBSLC1A3SLC1A2SLC1A1RAB9A
SCHEMBL21765857 0.76 RAB9A (1.00) POLBSLC1A3SLC1A2SLC1A1RAB9A
SCHEMBL11701768 0.75 RAB9A (0.75) POLBSLC1A3SLC1A2SLC1A1RAB9A
SCHEMBL23906985 0.75 POLB (0.51) POLBRAB9ANPC1HPGDMAPT
SCHEMBL2962505 0.74 MAOA (0.84) POLBRAB9ANPC1CYP1A2ADRA2A
SCHEMBL3984222 0.73 CYP1A2 (0.57) POLBSLC1A3SLC1A2SLC1A1RAB9A

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-2023099922-A1 INSECT NEUROPEPTIDE ANALOGUES Solasta Bio Limited (GB) 2023-06-08 WO disclosed