SCHEMBL5282518

SCHEMBL5282518

CCCCCCn1nnc(Br)c1CCCC

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.44
GRM2 Q14416 1/20 0.39
HCAR3 P49019 1/20 0.35
MAPT P10636 1/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
MAOB P27338 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
SMPD1 P17405 4/20 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
SCHEMBL5287644 0.93 SLC9A1 (0.44) SLC9A1GRM2HCAR3MAPTALDH1A1
SCHEMBL5282462 0.93 GRM2 (0.44) SLC9A1GRM2HCAR3MAOB
SCHEMBL5283666 0.89 GRM2 (0.39) SLC9A1GRM2ALDH1A1MAOB
SCHEMBL5283124 0.88 SLC9A1 (0.45) SLC9A1GRM2HCAR3MAPTALDH1A1
SCHEMBL5278986 0.86 GRM2 (0.44) SLC9A1GRM2HCAR3
SCHEMBL5273480 0.84 GRM2 (0.35) SLC9A1GRM2MAOB
SCHEMBL5278575 0.82 SLC9A1 (0.44) SLC9A1GRM2HCAR3MAPTALDH1A1
SCHEMBL5279525 0.82 SLC9A1 (0.41) SLC9A1GRM2HCAR3MAPTALDH1A1
SCHEMBL5280965 0.81 SLC9A1 (0.45) SLC9A1GRM2HCAR3MAPTALDH1A1
SCHEMBL5281801 0.81 SLC9A1 (0.45) SLC9A1GRM2HCAR3MAPTALDH1A1

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