SCHEMBL28322286

SCHEMBL28322286

Cc1ccccc1C(=O)OC1CNCCO1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SSTR4 P31391 5/20 0.45
SLC6A2 P23975 6/20 0.43
SLC6A4 P31645 6/20 0.43
BCHE P06276 1/20 0.41
SLC6A3 Q01959 4/20 0.41
PKM P14618 1/20 0.39
MAPT P10636 2/20 0.39
LMNA P02545 1/20 0.39
ADRB2 P07550 1/20 0.39
HTR1A P08908 1/20 0.39
HTR2A P28223 1/20 0.39
ADRA1A P35348 1/20 0.39
HTR2B P41595 1/20 0.39
ADRA2C P18825 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
SCHEMBL27470501 0.80 CHRNA7 (0.43) SLC6A2SLC6A4BCHESLC6A3LMNA
SCHEMBL28315283 0.73 SCN1A (0.45) SLC6A2SLC6A4SLC6A3
SCHEMBL13162864 0.71 CHEK1 (0.56) SSTR4SLC6A2SLC6A4MAPT
SCHEMBL9207735 0.71 SSTR4 (0.38) SSTR4SLC6A2SLC6A4SLC6A3
SCHEMBL2574276 0.71 KDM4E (0.40) BCHEMAPT
SCHEMBL322584 0.70 TAAR1 (0.50)
SCHEMBL14256169 0.70 MAPT (0.47) SLC6A2SLC6A4BCHESLC6A3PKM
SCHEMBL27929943 0.70 SCN1A (0.50) BCHEPKM
Hydrochloric Acid SCHEMBL23277053 0.70 SSTR4 (0.37) SSTR4SLC6A2SLC6A4SLC6A3
Hydrochloric Acid SCHEMBL20599528 0.70 SSTR4 (0.37) SSTR4SLC6A2SLC6A4SLC6A3

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
CN-105283454-B Quinazoline and azepine quinazoline as RAS/RAF/MEK/ERK and PI3K/AKT/PTEN/MTOR access double inhibitor ASANA BIOSCIENCES, LLC (US) 2019-10-29 CN disclosed