SCHEMBL5329219

SCHEMBL5329219

CCCCCCCCCCCCCC(C)c1nc(C)cn1C

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.38
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 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
SCHEMBL5334619 1.00 GPR84 (0.38) GPR84CHRNB2CHRNA4MEN1KMT2A
SCHEMBL5329525 1.00 GPR84 (0.38) GPR84CHRNB2CHRNA4MEN1KMT2A
SCHEMBL5331542 0.84 TLR8 (0.37) GPR84
SCHEMBL5328094 0.84 TLR8 (0.37) GPR84
SCHEMBL5329870 0.84 GPR84 (0.36) GPR84MEN1KMT2ANPSR1LMNA
SCHEMBL5333136 0.84 GPR84 (0.36) GPR84MEN1KMT2ANPSR1LMNA
SCHEMBL5328748 0.84 TLR8 (0.37) GPR84
SCHEMBL5329416 0.84 TLR8 (0.37) GPR84
SCHEMBL5328505 0.84 TLR8 (0.37) GPR84
SCHEMBL5331296 0.84 TLR8 (0.37) GPR84

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
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO disclosed