SCHEMBL1856262

SCHEMBL1856262

CCCC(C(=O)O)N1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 19/20 0.60
SLC6A2 P23975 17/20 0.60
SLC6A4 P31645 13/20 0.54

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
SCHEMBL29519179 0.98 SLC6A3 (0.58) SLC6A3SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL18939453 0.98 SLC6A3 (0.58) SLC6A3SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL18939593 0.96 SLC6A3 (0.57) SLC6A3SLC6A2SLC6A4
SCHEMBL30149132 0.96 SLC6A3 (0.56) SLC6A3SLC6A2SLC6A4
SCHEMBL22500187 0.86 SIGMAR1 (0.48) SLC6A3SLC6A2SLC6A4
SCHEMBL11847858 0.86 MAPT (0.48) SLC6A3SLC6A2SLC6A4
SCHEMBL22433662 0.85 GPR84 (0.48) SLC6A3SLC6A2SLC6A4
SCHEMBL18939600 0.84 SLC6A3 (0.45) SLC6A3SLC6A2SLC6A4
SCHEMBL28687392 0.83 MAPT (0.49) SLC6A3SLC6A2SLC6A4
SCHEMBL10448991 0.83 MAPT (0.49) SLC6A3SLC6A2SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108463723-B Isobaric and ectopic mass marker 电泳有限公司 2021-12-10 CN disclosed
EP-2323988-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS Wyeth LLC (US) 2011-05-25 EP disclosed
WO-2010009290-A1 ALPHA7 NICOTINIC ACETYLCHOLINE RECEPTOR INHIBITORS WYETH (US) 2010-01-21 WO disclosed