SCHEMBL5274377

SCHEMBL5274377

CCCCCCn1nnc(C(C)C)c1F

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 4/20 0.43
GCGR P47871 6/20 0.35
HCAR3 P49019 1/20 0.34
SMPD1 P17405 1/20 0.33
MAPT P10636 1/20 0.33
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32

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
SCHEMBL5275644 0.93 SLC9A1 (0.40) SLC9A1GCGRHCAR3ALDH1A1
SCHEMBL5281448 0.86 SLC9A1 (0.37) SLC9A1HCAR3ALDH1A1
SCHEMBL5276153 0.81 SLC9A1 (0.44) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5275491 0.81 SLC9A1 (0.44) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5283665 0.80 SLC9A1 (0.43) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5275072 0.80 SLC9A1 (0.43) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5275477 0.80 SLC9A1 (0.43) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5274793 0.80 SLC9A1 (0.40) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5276925 0.79 SLC9A1 (0.47) SLC9A1HCAR3SMPD1MAPTALDH1A1
SCHEMBL5279224 0.79 SLC9A1 (0.42) SLC9A1HCAR3MAPTALDH1A1LMNA

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