SCHEMBL25079220

SCHEMBL25079220

CC(C)(C)OC(=O)NCc1ccc(COc2ccc(-c3ccc(OCc4ccccc4)nc3OCc3ccccc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 3/20 0.52
▸ PTPN1 P18031 1/20 0.46
▸ PRMT5 O14744 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ PSMB1 P20618 7/20 0.44
▸ PSMB9 P28065 6/20 0.44
▸ PSMB5 P28074 6/20 0.44
▸ PSMB8 P28062 5/20 0.44
▸ ADAMTS5 Q9UNA0 1/20 0.44
▸ BCL2 P10415 1/20 0.43
▸ NTSR1 P30989 1/20 0.43
▸ PSMB10 P40306 3/20 0.42
▸ PSMB2 P49721 3/20 0.42
▸ POLB P06746 1/20 0.42
▸ GPR55 Q9Y2T6 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
SCHEMBL25079170 0.90 HDAC1 (0.45) HDAC1MEN1KMT2APSMB1PSMB9
SCHEMBL30817313 0.87 CA12 (0.48) PTPN1MEN1KMT2A
SCHEMBL31248684 0.85 MEN1 (0.42) HDAC1MEN1KMT2ANTSR1POLB
SCHEMBL31248947 0.85 HDAC1 (0.45) HDAC1MEN1KMT2APSMB1PSMB9
SCHEMBL31248643 0.85 HDAC1 (0.43) HDAC1MEN1KMT2APSMB1PSMB9
SCHEMBL25123736 0.85 KDM4E (0.42) PTPN1PRMT5MEN1KMT2AADAMTS5
SCHEMBL25123208 0.84 SUCNR1 (0.42) MEN1KMT2APOLB
SCHEMBL25123488 0.84 SUCNR1 (0.42) MEN1KMT2APOLB
SCHEMBL596575 0.84 HDAC1 (0.67) HDAC1MEN1KMT2AADAMTS5NTSR1
SCHEMBL25123002 0.83 BCHE (0.48) PTPN1PRMT5MEN1KMT2A

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-2023023531-A1 ESTROGEN RECEPTOR DEGRADERS, PHARMACEUTICAL COMPOSITIONS, AND THERAPEUTIC APPLICATIONS BIOTHERYX, INC. (US) 2023-02-23 — — WO disclosed
Send feedback