SCHEMBL7619941

SCHEMBL7619941

CC(C)C[C@H](N)C(=O)NCCc1c[nH]cn1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LARS1 Q9P2J5 3/20 0.39
AAK1 Q2M2I8 1/20 0.38
CIT O14578 5/20 0.36
HTT P42858 1/20 0.36
ATM Q13315 1/20 0.36
ANPEP P15144 2/20 0.35
RNPEP Q9H4A4 2/20 0.35
DNPEP Q9ULA0 1/20 0.35

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
SCHEMBL7619939 1.00 LARS1 (0.39) LARS1AAK1CITHTTATM
SCHEMBL5525994 0.86 HTT (0.38) HTTATM
SCHEMBL2820574 0.85 NLN (0.36) HTTATM
SCHEMBL27623099 0.85 NLN (0.36) HTTATM
SCHEMBL7624049 0.85 NLN (0.42)
SCHEMBL7624042 0.85 NLN (0.42)
Hydrochloric Acid SCHEMBL8652194 0.85 HTT (0.38) HTTATM
SCHEMBL15398762 0.85 NLN (0.39)
SCHEMBL23156818 0.84 KCNH2 (0.46)
SCHEMBL16458256 0.84 HTT (0.37) HTTATM

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
US-6448282-B1 H3 HISTAMINE RECEPTOR ANTAGONIST ACTIVITY; ALLERGY, INFLAMMATION, CARDIOVASCULAR DISEASE, DEPRESSION, SCHIZOPHRENIA, NARCOLEPSY, SLEEP APNEA, INSOMNIA, EPILEPSY, HYPOTHALAMIC DYSFUNCTION GLIATECH, INC. 2002-09-10 US disclosed
US-6166060-A 1H-4(5)-substituted imidazole derivatives GLIATECH, INC. (US) 2000-12-26 US disclosed