SCHEMBL8717282

SCHEMBL8717282

CCCCCCCCOC1CCC(C)(C)C(OC)C1c1nccn1C

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 3/20 0.32
CHRM2 P08172 1/20 0.32
TLR8 Q9NR97 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
SCHEMBL8717285 1.00 CHRM1 (0.32) CHRM1CHRM2TLR8
SCHEMBL8717755 0.80 LTA4H (0.31) CHRM1CHRM2
SCHEMBL8717759 0.80 LTA4H (0.31) CHRM1CHRM2
SCHEMBL8717963 0.79 CHRM1 (0.33) CHRM1CHRM2TLR8
SCHEMBL8714532 0.72 GBA1 (0.37)
SCHEMBL8714531 0.72 GBA1 (0.37)
SCHEMBL8714536 0.72 GBA1 (0.37)
SCHEMBL8717278 0.72 GBA1 (0.30)
SCHEMBL9250010 0.72 TBXAS1 (0.39)
SCHEMBL8717894 0.71 GBA1 (0.37)

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
US-5719291-A FUNGICIDE HOFFMANN-LA ROCHE INC. (US) 1998-02-17 US disclosed