SCHEMBL8580292

SCHEMBL8580292

C(#Cc1ccccc1)c1[c]c2c(cc1)-c1ccc(C#Cc3ccccc3)cc1C2

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 17/20 0.47
APP P05067 1/20 0.35
FFAR1 O14842 1/20 0.34
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 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
SCHEMBL8677958 0.88 APP (0.38) GRM5APPCA12CA1CA2
SCHEMBL8579921 0.81 CYP1A1 (0.31)
SCHEMBL8577931 0.81 GRM5 (0.61) GRM5APPFFAR1
SCHEMBL8581528 0.77 APP (0.33) APP
SCHEMBL8911138 0.76 GRM5 (0.56) GRM5APP
SCHEMBL8578937 0.73 NPC1 (0.37) GRM5FFAR1
SCHEMBL8677974 0.71 ALDH1A1 (0.39)
SCHEMBL10669403 0.68 GRM5 (0.62) GRM5APPFFAR1
SCHEMBL2191154 0.67 APP (0.63) GRM5APPFFAR1CA12CA1
SCHEMBL328827 0.67 MAPT (0.37) CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5705578-A Method for making and using a supported metallocene catalyst system PHILLIPS PETROLEUM COMPANY (US) 1998-01-06 US claimed
US-5830958-A Polynuclear metallocene preparation and use PHILLIPS PETROLEUM COMPANY (US) 1998-11-03 US disclosed
US-5705578-A Method for making and using a supported metallocene catalyst system PHILLIPS PETROLEUM COMPANY (US) 1998-01-06 US disclosed