SCHEMBL5285138

SCHEMBL5285138

CCCCCCn1nnc(C)c1C(Cl)(Cl)C(Cl)(Cl)Cl

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.41
HCAR3 P49019 1/20 0.33
SMPD1 P17405 4/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
GRM2 Q14416 1/20 0.31
CNR1 P21554 1/20 0.30
CNR2 P34972 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
SCHEMBL5276320 0.94 SLC9A1 (0.38) SLC9A1HCAR3GRM2
SCHEMBL5279214 0.87 SLC9A1 (0.43) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5283830 0.87 SLC9A1 (0.35) SLC9A1ALDH1A1GRM2
SCHEMBL5278425 0.84 SLC9A1 (0.41) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5274494 0.84 SLC9A1 (0.41) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5276368 0.83 SLC9A1 (0.40) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5275517 0.83 SLC9A1 (0.40) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5290014 0.83 SLC9A1 (0.40) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5289903 0.83 SLC9A1 (0.40) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5286214 0.82 SLC9A1 (0.44) SLC9A1HCAR3SMPD1MAPTALDH1A1

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