SCHEMBL5489747

SCHEMBL5489747

FC(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)CCCOc1ccc(S)cc1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.35
PPARA Q07869 3/20 0.32
USP2 O75604 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
KCNA3 P22001 1/20 0.31

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
SCHEMBL5959986 0.83 KCNA3 (0.50) PPARAKCNA3
SCHEMBL1751270 0.83 APP (0.34) MAOB
SCHEMBL3779536 0.81 HRH3 (0.42) MAOBPPARA
SCHEMBL3424352 0.81 HRH3 (0.42) MAOBPPARA
SCHEMBL18028239 0.80 PSMB1 (0.41) PPARAUSP2MAPTTSHR
SCHEMBL3480749 0.80 CHRNB4 (0.43) MAOBPPARAMAPT
SCHEMBL896329 0.80 ALDH1A1 (0.48) MAOBPPARAMAPT
SCHEMBL27096233 0.79 HRH3 (0.43) MAOBPPARA
SCHEMBL13612667 0.78 CHRNB4 (0.44) MAOBPPARAMAPT
SCHEMBL9141866 0.78 NR5A1 (0.50)

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-1856530-A2 FLUOROUS-BASED MICROARRAYS Iowa State University Research Foundation, Inc. (US) 2007-11-21 EP disclosed
WO-2006094194-A2 FLUOROUS-BASED MICROARRAYS IOWA STATE UNIVERSITY RESEARCH FOUNDATION, INC. (US) 2006-09-08 WO disclosed