SCHEMBL7459073

SCHEMBL7459073

CC(C)n1cc(CCCl)cn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.39
PDE8B O95263 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
JAK2 O60674 4/20 0.33
FLT3 P36888 3/20 0.33
MAPT P10636 2/20 0.33
ABL1 P00519 1/20 0.32
ALPL P05186 1/20 0.32
ALPI P09923 1/20 0.32
ALPG P10696 1/20 0.32
RIN1 Q13671 1/20 0.32
KMT2A Q03164 3/20 0.32
JAK1 P23458 1/20 0.31
TYK2 P29597 1/20 0.31
JAK3 P52333 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MEN1 O00255 1/20 0.31
PIK3CD O00329 1/20 0.31
PIP5K1C O60331 1/20 0.31

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
SCHEMBL7992626 0.84 ACHE (0.41) ACHEPDE8BL3MBTL1JAK2FLT3
SCHEMBL13181031 0.82 ACHE (0.40) ACHEPDE8BL3MBTL1MAPTKMT2A
SCHEMBL1197140 0.81 ACHE (0.42) ACHEPDE8BL3MBTL1MAPTABL1
SCHEMBL13126452 0.79 ACHE (0.38) ACHEPDE8BL3MBTL1JAK2FLT3
SCHEMBL1161159 0.78 ACHE (0.42) ACHEPDE8BL3MBTL1MAPTABL1
SCHEMBL23638714 0.77 TDP1 (0.39) ACHEL3MBTL1MAPTKMT2AALDH1A1
SCHEMBL5212545 0.76 ACHE (0.41) ACHEPDE8BL3MBTL1MAPTABL1
SCHEMBL21743170 0.76 GABRA1 (0.50) ACHEPDE8BL3MBTL1MAPTABL1
SCHEMBL21303995 0.76 ACHE (0.41) ACHEPDE8BL3MBTL1MAPTABL1
SCHEMBL1106841 0.76 ACHE (0.41) ACHEPDE8BL3MBTL1MAPTABL1

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-0708102-B1 5-HT1F agonists for the treatment of migraine LILLY CO ELI (US) 2002-12-11 EP disclosed
US-5721252-A PIPERIDINYL-1H-INDOLE DERIVATIVES ELI LILLY AND COMPANY (US) 1998-02-24 US disclosed
US-5521196-A ANALGESICS USING SEROTONIN ANTAGONIST ELI LILLY AND COMPANY (US) 1996-05-28 US disclosed
EP-0708102-A1 5-HT1F agonists for the treatment of migraine ELI LILLY AND COMPANY (US) 1996-04-24 EP disclosed