SCHEMBL27446754

SCHEMBL27446754

CNCCOCCOCCNC(=O)CBr

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.37
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CA2 P00918 5/20 0.34
CA12 O43570 4/20 0.34
CA1 P00915 4/20 0.34
CA4 P22748 4/20 0.34
CA9 Q16790 4/20 0.34
CA14 Q9ULX7 4/20 0.34
TSHR P16473 1/20 0.32
HDAC3 O15379 2/20 0.31
HDAC4 P56524 2/20 0.31
HDAC1 Q13547 2/20 0.31
HDAC7 Q8WUI4 2/20 0.31
HDAC2 Q92769 2/20 0.31
HDAC10 Q969S8 2/20 0.31
HDAC11 Q96DB2 2/20 0.31

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
SCHEMBL7547013 0.90 MEN1 (0.47) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL21748011 0.85 KDM4E (0.46) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL16949526 0.85 MEN1 (0.44) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL20197917 0.85 KDM4E (0.46) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL18120313 0.85 MEN1 (0.44) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL24894030 0.85 MEN1 (0.44) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL17696614 0.84 MEN1 (0.41) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL14005135 0.82 MEN1 (0.41) MEN1KMT2ASMN1; SMN2KDM4EGLA
SCHEMBL24514349 0.82 MEN1 (0.50) MEN1KMT2ASMN1; SMN2CA2CA12
SCHEMBL15757921 0.82 SMN1; SMN2 (0.42) MEN1KMT2ASMN1; SMN2KDM4EGLA

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
EP-3355931-B1 PROTEIN CONJUGATES NOVO NORDISK AS (DK) 2024-06-26 EP disclosed