SCHEMBL4599491

SCHEMBL4599491

O=C(CC(=O)C(F)(F)C(F)(F)C(F)(F)F)c1cc2ccccc2s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.50
HDAC4 P56524 1/20 0.50
HDAC1 Q13547 1/20 0.50
HDAC7 Q8WUI4 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC10 Q969S8 1/20 0.50
HDAC11 Q96DB2 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
HDAC9 Q9UKV0 1/20 0.50
HDAC5 Q9UQL6 1/20 0.50
BCL2L1 Q07817 1/20 0.49
RAB9A P51151 1/20 0.44
SLC9A1 P19634 2/20 0.43
HRH4 Q9H3N8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TAS1R3 Q7RTX0 2/20 0.42
TAS1R1 Q7RTX1 2/20 0.42
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42

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
SCHEMBL30610436 1.00 HDAC3 (0.50) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL4599031 0.92 HDAC3 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL30610438 0.92 HDAC3 (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1639689 0.86 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL9585720 0.76 BCL2L1 (0.66) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5162433 0.75 HDAC3 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10874235 0.73 GSK3B (0.53)
SCHEMBL1095075 0.73 PTPN1 (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL28118458 0.73 BCL2L1 (0.65) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL5162744 0.73 HDAC3 (0.57) HDAC3HDAC4HDAC1HDAC7HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1483582-B1 DISSOCIATIVE FLUORESCENCE ENHANCEMENT ASSAY WALLAC OY (FI) 2008-04-16 EP claimed
US-7211440-B2 Dissociative fluorescence enhancement assay WALLAC OY (FI) 2007-05-01 US claimed
US-20030170907-A1 Dissociative fluorescence enhancement assay WALLAC OY (FI) 2003-09-11 US claimed
EP-2841943-B1 METHOD FOR CHARACTERIZING AND/OR DETERMINING SAMPLES KEMIRA OYJ (FI) 2023-09-27 EP disclosed
US-20160258936-A1 METHOD FOR ANALYZING GAS SAMPLES TURUN YLIOPISTO (FI) 2016-09-08 US disclosed
US-20150094234-A1 Method for characterizing and/or determining samples AQSENS OY (FI) 2015-04-02 US disclosed
EP-2841943-A1 METHOD FOR CHARACTERIZING AND/OR DETERMINING SAMPLES Aqsens Oy (FI) 2015-03-04 EP disclosed
WO-2013160547-A1 METHOD FOR CHARACTERIZING AND/OR DETERMINING SAMPLES HAERMAE HARRI (FI) 2013-10-31 WO disclosed
US-7381567-B2 Dissociative fluorescence enhancement assay WALLAC OY (FI) 2008-06-03 US disclosed
EP-1483582-B1 DISSOCIATIVE FLUORESCENCE ENHANCEMENT ASSAY WALLAC OY (FI) 2008-04-16 EP disclosed
US-7211440-B2 Dissociative fluorescence enhancement assay WALLAC OY (FI) 2007-05-01 US disclosed
US-20070015284-A1 Dissociative fluorescence enhancement assay HEMMILA ILKKA 2007-01-18 US disclosed
EP-1483582-A1 DISSOCIATIVE FLUORESCENCE ENHANCEMENT ASSAY WALLAC OY (FI) 2004-12-08 EP disclosed
WO-2003076939-A1 DISSOCIATIVE FLUORESCENCE ENHANCEMENT ASSAY WALLAC OY (FI) 2003-09-18 WO disclosed
US-20030170907-A1 Dissociative fluorescence enhancement assay WALLAC OY (FI) 2003-09-11 US disclosed