SCHEMBL25394661

SCHEMBL25394661

COc1ccc2c(c1)C(c1ccc(Cl)cc1)=N[C@@H](CC(=O)NCCOCCOCCOCCOCCOCCOCCNC(=O)O)c1nnc(C)n1-2

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 20/20 0.79
▸ BRD2 P25440 2/20 0.79
▸ SMCHD1 A6NHR9 1/20 0.79
▸ MYO1G B0I1T2 1/20 0.79
▸ AIP O00170 1/20 0.79
▸ AP3B1 O00203 1/20 0.79
▸ PSMD11 O00231 1/20 0.79
▸ CDC7 O00311 1/20 0.79
▸ SAP18 O00422 1/20 0.79
▸ KPNA3 O00505 1/20 0.79
▸ PPP6C O00743 1/20 0.79
▸ TCERG1 O14776 1/20 0.79
▸ UBE2L6 O14933 1/20 0.79
▸ PPP1R12A O14974 1/20 0.79
▸ U2SURP O15042 1/20 0.79
▸ SETD1A O15047 1/20 0.79
▸ ARPC1B O15143 1/20 0.79
▸ POLR1C O15160 1/20 0.79
▸ OGT O15294 1/20 0.79
▸ PPM1G O15355 1/20 0.79

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
SCHEMBL14744951 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL15969378 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL14740856 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL16758238 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL25263094 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL25398164 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL25395249 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL25395400 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL15968908 1.00 BRD4 (0.79) BRD4BRD2SMCHD1MYO1GAIP
SCHEMBL15970062 0.98 BRD4 (0.82) BRD4BRD2SMCHD1MYO1GAIP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023172889-A1 USE OF CHEMICAL EPIGENETIC MODIFIERS TO MODULATE GENE EXPRESSION THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-09-14 — — WO disclosed
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