SCHEMBL6609964

SCHEMBL6609964

Cc1ccccc1[I+]c1ccccc1C.Fc1c(F)c(F)c([B-](c2c(F)c(F)c(F)c(F)c2F)(c2c(F)c(F)c(F)c(F)c2F)c2c(F)c(F)c(F)c(F)c2F)c(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.37
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.32
KDM4C Q9H3R0 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
SCHEMBL30047690 0.90 ACHE (0.32) ACHE
SCHEMBL31668371 0.87 ALDH1A1 (0.35) TSHR
SCHEMBL3762885 0.87 ALDH1A1 (0.35) TSHR
SCHEMBL29547824 0.84 ACHE (0.33) ACHETSHR
O-Xylene SCHEMBL30386408 0.81 TSHR (0.48) ACHETSHRHTTKDM4C
O-Xylene SCHEMBL30509215 0.81 TSHR (0.48) ACHETSHRHTTKDM4C
SCHEMBL4139925 0.79 ACHE (0.46) ACHETSHRHTT
SCHEMBL29628828 0.78 ACHE (0.38) ACHETSHRHTTKDM4C
O-Tolylamine SCHEMBL578081 0.78 ACHE (0.38) ACHETSHRHTTKDM4C
SCHEMBL146110 0.78 TSHR (0.53) ACHETSHRHTT

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
EP-1029258-B1 HOLOGRAPHIC MEDIUM AND PROCESS POLAROID CORP (US) 2004-05-12 EP disclosed
US-20030157414-A1 HOLOGRAPHIC MEDIUM AND PROCESS FOR USE THEREOF SENSHIN CAPITAL, LLC 2003-08-21 US disclosed