SCHEMBL20157002

SCHEMBL20157002

CCCCCCNc1cc(C)c(CC)cc1C

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 10/20 0.41
DNM2 P50570 1/20 0.38
ADRA2A P08913 1/20 0.38
CISD1 Q9NZ45 5/20 0.37
HCAR3 P49019 1/20 0.37

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
SCHEMBL7528975 0.79 EPHX1 (0.39) GPR84DNM2ADRA2ACISD1
SCHEMBL11023376 0.74 CYP3A4 (0.40) GPR84DNM2ADRA2ACISD1
SCHEMBL12959658 0.74 PRSS1 (0.41) GPR84DNM2CISD1
SCHEMBL5284421 0.74 GUCY1A1 (0.54)
SCHEMBL11329911 0.74 PLK1 (0.47)
SCHEMBL11329867 0.74 PLK1 (0.47)
SCHEMBL11337228 0.74 PLK1 (0.47)
SCHEMBL11331968 0.74 PLK1 (0.47)
SCHEMBL11335028 0.74 PLK1 (0.47)
SCHEMBL11338770 0.74 PLK1 (0.47)

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-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed