SCHEMBL5276153

SCHEMBL5276153

CCCCCCn1nnc(C(C)C)c1C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.44
HCAR3 P49019 1/20 0.35
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
GRM2 Q14416 1/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
SMPD1 P17405 3/20 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
SCHEMBL5277203 0.93 SLC9A1 (0.41) SLC9A1HCAR3ALDH1A1GRM2
SCHEMBL5278079 0.85 SLC9A1 (0.38) SLC9A1HCAR3ALDH1A1GRM2
SCHEMBL5275491 0.83 SLC9A1 (0.44) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5275072 0.81 SLC9A1 (0.43) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5274377 0.81 SLC9A1 (0.43) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5283665 0.81 SLC9A1 (0.43) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5275477 0.81 SLC9A1 (0.43) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5279224 0.80 SLC9A1 (0.42) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5274246 0.80 SLC9A1 (0.42) SLC9A1HCAR3MAPTALDH1A1LMNA
SCHEMBL5277920 0.79 SLC9A1 (0.41) SLC9A1HCAR3ALDH1A1LMNACNR1

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