SCHEMBL19789970

SCHEMBL19789970

Bc1ccc(C#Cc2ccc(-c3ccc(C#Cc4ccccc4)c(CCC)c3)cc2CCC)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 10/20 0.39
KCNH2 Q12809 2/20 0.35
FFAR4 Q5NUL3 5/20 0.34
NPC1 O15118 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
CYP1A2 P05177 2/20 0.33
CYP1A1 P04798 1/20 0.33
CYP1B1 Q16678 1/20 0.33
APP P05067 1/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 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
SCHEMBL19790014 0.89 FFAR1 (0.44) FFAR1KCNH2FFAR4NPC1SMN1; SMN2
SCHEMBL19790015 0.85 FFAR1 (0.35) FFAR1MTNR1AMTNR1B
SCHEMBL19789963 0.77 FFAR1 (0.41) FFAR1FFAR4NPC1SMN1; SMN2HTT
SCHEMBL19790008 0.77 KCNH2 (0.41) FFAR1KCNH2FFAR4NPC1SMN1; SMN2
SCHEMBL18201798 0.75 AAK1 (0.34) FFAR1KCNH2
SCHEMBL19308539 0.72 FFAR1 (0.37) FFAR1FFAR4NPC1SMN1; SMN2HTT
SCHEMBL24390823 0.71 APP (0.41) FFAR1KCNH2FFAR4NPC1SMN1; SMN2
SCHEMBL19789973 0.71 APP (0.41) FFAR1KCNH2FFAR4NPC1SMN1; SMN2
SCHEMBL19789800 0.71 APP (0.41) FFAR1KCNH2FFAR4NPC1SMN1; SMN2
SCHEMBL22225396 0.71 APP (0.67) FFAR1KCNH2FFAR4NPC1SMN1; SMN2

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-2794816-B1 LIQUID CRYSTAL MEDIUM AND HIGH FREQUENCY COMPONENTS COMPRISING SAME MERCK PATENT GMBH (DE) 2018-01-24 EP disclosed