SCHEMBL25636583

SCHEMBL25636583

CC(C)C(=O)C(CCCNC(N)=O)NC(=O)C(NC(=O)CCCCCN1C(=O)CC(C(C)C)C1=O)C(C)C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35
▸ HDAC11 Q96DB2 1/20 0.35
▸ HDAC8 Q9BY41 1/20 0.35
▸ HDAC6 Q9UBN7 1/20 0.35
▸ HDAC9 Q9UKV0 1/20 0.35
▸ HDAC5 Q9UQL6 1/20 0.35
▸ FOLH1 Q04609 3/20 0.33
▸ CTSL P07711 1/20 0.33
▸ OPRL1 P41146 3/20 0.33
▸ EPHX2 P34913 2/20 0.33
▸ NMT2 O60551 2/20 0.33
▸ NMT1 P30419 2/20 0.33
▸ FURIN P09958 2/20 0.32
▸ HRH1 P35367 2/20 0.32
▸ NPY1R P25929 1/20 0.32

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
SCHEMBL24722050 1.00 HDAC3 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21322755 0.93 HDAC3 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21648844 0.93 HDAC3 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21534477 0.91 HDAC3 (0.34) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL25637037 0.91 HDAC3 (0.35) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20078590 0.89 HDAC3 (0.40) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20053682 0.89 HDAC3 (0.48) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21534471 0.89 FURIN (0.34) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL20078600 0.88 HDAC3 (0.34) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL21534452 0.88 FURIN (0.34) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023107674-A2 STAPLED PEPTIDE-ANTIBODY CONJUGATES (SPACS) AND USES THEREOF LYTICA THERAPEUTICS, INC. (US) 2023-06-15 — — WO disclosed
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