SCHEMBL5277296

SCHEMBL5277296

CCCCn1nnc(CC(C)C)c1Cl

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 5/20 0.41
GRM2 Q14416 1/20 0.35
HCAR3 P49019 2/20 0.35
TOP2A P11388 1/20 0.33
GRIA4 P48058 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
SCHEMBL5277210 0.94 SLC9A1 (0.44) SLC9A1GRM2HCAR3
SCHEMBL5279519 0.90 SLC9A1 (0.39) SLC9A1GRM2HCAR3TOP2AGRIA4
SCHEMBL5278235 0.86 SLC9A1 (0.42) SLC9A1GRM2HCAR3TOP2A
SCHEMBL5285518 0.82 SLC9A1 (0.35) SLC9A1GRIA4
SCHEMBL5288212 0.81 SLC9A1 (0.39) SLC9A1GRM2HCAR3TOP2A
SCHEMBL5284360 0.81 SLC9A1 (0.39) SLC9A1GRM2HCAR3TOP2A
SCHEMBL5283153 0.81 SLC9A1 (0.39) SLC9A1GRM2HCAR3TOP2AGRIA4
SCHEMBL5277642 0.81 SLC9A1 (0.41) SLC9A1GRM2HCAR3TOP2A
SCHEMBL5272914 0.81 SLC9A1 (0.41) SLC9A1GRM2HCAR3TOP2A
SCHEMBL5288686 0.80 SLC9A1 (0.38) SLC9A1GRM2HCAR3TOP2AGRIA4

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
EP-1859781-A2 Brightening and/or colouring agent with triazoles Henkel Kommanditgesellschaft auf Aktien (DE) 2007-11-28 EP disclosed