SCHEMBL8983535

SCHEMBL8983535

CC(I)CCCC(C)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.52
TAAR1 Q96RJ0 3/20 0.48
TRPA1 O75762 4/20 0.44
AOC3 Q16853 2/20 0.44
HTR2A P28223 2/20 0.38
HRH1 P35367 2/20 0.38

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
SCHEMBL8983491 0.87 RIPK1 (0.55) RIPK1TAAR1TRPA1AOC3
SCHEMBL1046087 0.81 RIPK1 (0.53) RIPK1TAAR1TRPA1AOC3HTR2A
SCHEMBL6280516 0.79 RIPK1 (0.67) RIPK1TAAR1TRPA1AOC3
SCHEMBL5379147 0.79 RIPK1 (0.52) RIPK1TAAR1TRPA1AOC3
SCHEMBL1144320 0.79 RIPK1 (0.52) RIPK1TAAR1TRPA1AOC3
SCHEMBL190051 0.78 RIPK1 (0.55) RIPK1TAAR1TRPA1AOC3
SCHEMBL14445672 0.78 RIPK1 (0.50) RIPK1TAAR1TRPA1AOC3
SCHEMBL5213988 0.77 RIPK1 (0.64) RIPK1TAAR1TRPA1AOC3
Lithium SCHEMBL30777534 0.77 RIPK1 (0.64) RIPK1TAAR1TRPA1AOC3
Ammonia Solution, Strong SCHEMBL6014509 0.77 RIPK1 (0.53) RIPK1TAAR1TRPA1AOC3

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
US-5561143-A ANTICHOLESTEROL AGENTS, ANTILIPEMIC AGENTS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-10-01 US disclosed
US-5534532-A ANTICHOLESTEROL AGENTS, SQUALENE SYNTHASE INHIBITOR RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-07-09 US disclosed
US-5455260-A Anticholesterol agents; reduction of serum cholesterol without reducing mevalonic metabolite synthesis; side effect RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-10-03 US disclosed
WO-1994027601-A1 ALIPHATIC AMINO BIS-ARYL SQUALENE SYNTHASE INHIBITORS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-12-08 WO disclosed