SCHEMBL29205147

SCHEMBL29205147

N#CC(=C1CCN(C(=O)N2CCc3[nH]ncc3C2)CC1)c1ccc(SCl)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.39
PROKR1 Q8TCW9 4/20 0.35
SPR P35270 2/20 0.34
ENPP2 Q13822 1/20 0.33
RORC P51449 1/20 0.30

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
SCHEMBL27166043 0.89 PROKR1 (0.45) NAMPTPROKR1SPRENPP2
SCHEMBL27166038 0.87 NAMPT (0.52) NAMPTPROKR1SPRENPP2RORC
SCHEMBL30055886 0.83 NAMPT (0.45) NAMPTPROKR1SPRENPP2RORC
SCHEMBL27166042 0.83 NAMPT (0.45) NAMPTPROKR1SPRENPP2RORC
SCHEMBL27166157 0.82 PROKR1 (0.49) NAMPTPROKR1SPRENPP2
SCHEMBL27166147 0.81 NAMPT (0.45) NAMPTPROKR1SPRENPP2RORC
SCHEMBL29205123 0.80 NAMPT (0.38) NAMPTPROKR1
SCHEMBL29205179 0.79 HSP90AA1 (0.37) PROKR1
SCHEMBL30057747 0.79 NAMPT (0.35) NAMPTPROKR1SPRENPP2
SCHEMBL27166139 0.79 NAMPT (0.35) NAMPTSPRENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117794899-A Novel heterocyclic compounds, compositions, methods of preparation and uses thereof 欧加农研发芬兰有限公司 2024-03-29 CN disclosed