SCHEMBL5488236

SCHEMBL5488236

O=C(CCc1ccccc1)Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 4/20 1.00
PGR P06401 1/20 0.67
POLB P06746 3/20 0.66
TDP1 Q9NUW8 2/20 0.66
KDM4E B2RXH2 1/20 0.66
MEN1 O00255 1/20 0.66
DUSP3 P51452 1/20 0.66
PTPN5 P54829 1/20 0.66
KMT2A Q03164 1/20 0.66
PTPN11 Q06124 1/20 0.66
CTDSP1 Q9GZU7 1/20 0.66
MAPT P10636 1/20 0.61
HTT P42858 1/20 0.61
HDAC3 O15379 3/20 0.57
HDAC2 Q92769 3/20 0.57
HDAC4 P56524 2/20 0.57
HDAC7 Q8WUI4 2/20 0.57
HDAC10 Q969S8 2/20 0.57
HDAC11 Q96DB2 2/20 0.57
HDAC8 Q9BY41 2/20 0.57

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
SCHEMBL1747121 0.88 HDAC1 (0.79) HDAC1PGRPOLBTDP1KDM4E
SCHEMBL22192258 0.84 PGR (0.93) HDAC1PGRPOLBKDM4EMEN1
SCHEMBL2356413 0.84 HDAC1 (0.72) HDAC1MEN1KMT2AMAPTHTT
SCHEMBL2171203 0.82 HDAC1 (0.71) HDAC1POLBMAPTHTTHDAC3
SCHEMBL17069875 0.82 HDAC1 (0.70) HDAC1POLBMAPTHTTHDAC3
SCHEMBL2832427 0.82 MAPT (0.71) HDAC1POLBTDP1KDM4EMEN1
SCHEMBL673562 0.82 HDAC1 (0.82) HDAC1POLBTDP1KDM4EMEN1
SCHEMBL1747191 0.82 HDAC1 (0.69) HDAC1PGRPOLBTDP1KDM4E
SCHEMBL5694520 0.81 PGR (1.00) HDAC1PGRPOLBKDM4EMEN1
SCHEMBL19619022 0.81 PGR (0.86) HDAC1PGRMEN1KMT2AHDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025059442-A1 MODULATING PLANT RESPONSES TO STRESS AND GROWTH WITH CHEMICALS REMOTE EPIGENETICS INC. (US) 2025-03-20 WO claimed
WO-2025059442-A1 MODULATING PLANT RESPONSES TO STRESS AND GROWTH WITH CHEMICALS REMOTE EPIGENETICS INC. (US) 2025-03-20 WO disclosed
US-20070207120-A1 Selective Killing Of Cancer Cells By Induction Of Acetyltransferase Via Tnf-Alpha And Il-6 DRAYTON SARAH 2007-09-06 US disclosed
EP-1755649-A1 SELECTIVE KILLING OF CANCER CELLS BY INDUCTION OF ACETYLTRANSFERASE VIA TNF-ALPHA AND IL-6 Medical Research Council (GB) 2007-02-28 EP disclosed
WO-2005099747-A1 SELECTIVE KILLING OF CANCER CELLS BY INDUCTION OF ACETYLTRANSFERASE VIA TNF-ALPHA AND IL-6 MEDICAL RESEARCH COUNCIL (GB) 2005-10-27 WO disclosed