SCHEMBL6184867

SCHEMBL6184867

Cc1nc(C2(CN)CCCCC2)cs1

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 6/20 0.42
SLC6A3 Q01959 15/20 0.38
SLC6A4 P31645 13/20 0.38
DPP4 P27487 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL6032430 0.75 MAPK1 (0.31) MAPK1
SCHEMBL21610740 0.75 MAPK1 (0.40) MAPK1
SCHEMBL22549094 0.74 MAPK1 (0.31) MAPK1
SCHEMBL21610738 0.73 MAPK1 (0.38) MAPK1
SCHEMBL12869685 0.72 MAPK1 (0.34) MAPK1
SCHEMBL2389630 0.71 MAPK1 (0.33) MAPK1
Hydrochloric Acid SCHEMBL1173700 0.70 MAPK1 (0.33) MAPK1
SCHEMBL6182182 0.70 MAPK1 (0.37) MAPK1
SCHEMBL21610732 0.69 MAPK1 (0.35) MAPK1
SCHEMBL15888824 0.69 MAPK1 (0.33) MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0920424-B1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER LAMBERT CO (US) 2005-11-30 EP disclosed
US-6194437-B1 ANTIDEPRESSANTS; ANTICANCER AGENTS; GASTROINTESTINAL DISORDERS; COGNITION ACTIVATORS WARNER-LAMBERT COMPANY 2001-02-27 US disclosed
EP-0920424-A1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1999-06-09 EP disclosed
WO-1998007718-A1 NON-PEPTIDE BOMBESIN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 1998-02-26 WO disclosed