SCHEMBL3900259

SCHEMBL3900259

C(#Cc1ccccc1)C1=C(c2ccccc2)C2CCC1C2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
FFAR1 O14842 3/20 0.38
MAPT P10636 3/20 0.34
KCNH2 Q12809 2/20 0.34
KDM4E B2RXH2 2/20 0.34
MEN1 O00255 2/20 0.34
NPC1 O15118 2/20 0.34
KMT2A Q03164 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
LMNA P02545 1/20 0.34
CASP3 P42574 1/20 0.34
RAB9A P51151 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
GRM5 P41594 4/20 0.32
CYP1A2 P05177 2/20 0.32
CYP1A1 P04798 1/20 0.32
CYP1B1 Q16678 1/20 0.32
CHRNB2 P17787 2/20 0.32
CHRNA4 P43681 2/20 0.32
CHRNB4 P30926 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
SCHEMBL3902761 0.77 PTGS2 (0.43) NPC1LMNARAB9ACHRNB2CHRNA4
SCHEMBL2779049 0.68 PTGS2 (0.38) NPC1LMNARAB9ACHRNB2CHRNA4
SCHEMBL3714277 0.67 APP (0.55) APPFFAR1MAPTKDM4EMEN1
Diphenylacetylene SCHEMBL27926128 0.67 APP (0.80) APPFFAR1MAPTKCNH2KDM4E
Diphenylacetylene SCHEMBL21271527 0.67 APP (0.80) APPFFAR1MAPTKCNH2KDM4E
SCHEMBL2500697 0.64 CHRNB2 (0.36) NPC1LMNARAB9ACHRNB2CHRNA4
SCHEMBL444972 0.64 PTGS2 (0.35) KDM4ENPC1RAB9ACHRNB2CHRNA4
Diphenylacetylene SCHEMBL68254 0.64 APP (1.00) APPFFAR1MAPTKCNH2KDM4E
Diphenylacetylene SCHEMBL960609 0.64 APP (1.00) APPFFAR1MAPTKCNH2KDM4E
Diphenylacetylene SCHEMBL29188592 0.64 APP (1.00) APPFFAR1MAPTKCNH2KDM4E

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7550546-B2 Norbornene-based polymers, films, polarizing plates and liquid crystal display devices FUJIFILM CORPORATION (JP) 2009-06-23 US disclosed
US-20080033133-A1 NORBORNENE-BASED POLYMERS, FILMS, POLARIZING PLATES AND LIQUID CRYSTAL DISPLAY DEVICES FUJIFILM CORPORATION (JP) 2008-02-07 US disclosed