SCHEMBL23728867

SCHEMBL23728867

CCCNC(=O)c1nc(NC(=O)CCNC(=O)c2cc(NC(=O)c3nc(NC(=O)CCNC(=O)c4cc(NC(=O)c5nc(NC(=O)O)cn5C)cn4C)cn3C)cn2C)cn1C

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.59
HDAC2 Q92769 2/20 0.59
HDAC8 Q9BY41 2/20 0.59
TOP1 P11387 2/20 0.44
HRAS P01112 9/20 0.44
ESR1 P03372 9/20 0.44
ESR2 Q92731 9/20 0.44
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
HIF1A Q16665 1/20 0.43
ERBB2 P04626 5/20 0.41
EP300 Q09472 2/20 0.38

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
SCHEMBL23728614 0.98 HDAC1 (0.62) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL25198378 0.91 HDAC1 (0.58) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL25204974 0.90 HDAC1 (0.57) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL23745114 0.89 HDAC1 (0.60) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL23728692 0.87 HDAC1 (0.55) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL30125647 0.87 HDAC1 (0.59) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL30125594 0.87 HDAC1 (0.59) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL23728729 0.87 HDAC1 (0.55) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL28984114 0.87 HDAC1 (0.55) HDAC1HDAC2HDAC8TOP1HRAS
SCHEMBL28984148 0.87 HDAC1 (0.55) HDAC1HDAC2HDAC8TOP1HRAS

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-4100404-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. (US) 2022-12-14 EP disclosed
WO-2021158707-A1 METHODS AND COMPOUNDS FOR THE TREATMENT OF GENETIC DISEASE Design Therapeutics, Inc. (US) 2021-08-12 WO disclosed