SCHEMBL5284919

SCHEMBL5284919

CCCCCCn1nnc(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.47
HCAR3 P49019 1/20 0.37
MAPT P10636 1/20 0.35
GRM2 Q14416 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
SMPD1 P17405 4/20 0.33
PTGS1 P23219 3/20 0.33
PTGS2 P35354 3/20 0.33
MGLL Q99685 2/20 0.33
FAAH O00519 1/20 0.33
TOP2A P11388 1/20 0.33

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
SCHEMBL5276096 0.92 SLC9A1 (0.44) SLC9A1HCAR3GRM2ALDH1A1TOP2A
SCHEMBL5275766 0.84 SLC9A1 (0.41) SLC9A1HCAR3GRM2ALDH1A1TOP2A
SCHEMBL5278509 0.83 SLC9A1 (0.46) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5281115 0.83 SLC9A1 (0.46) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5275921 0.81 SLC9A1 (0.45) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5281570 0.81 SLC9A1 (0.45) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5281120 0.81 SLC9A1 (0.45) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5277631 0.81 SLC9A1 (0.45) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5281159 0.81 SLC9A1 (0.45) SLC9A1HCAR3MAPTGRM2ALDH1A1
SCHEMBL5278202 0.81 SLC9A1 (0.45) SLC9A1HCAR3MAPTGRM2ALDH1A1

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