SCHEMBL23768536

SCHEMBL23768536

O=C(O)CCNC(=O)NCCNC(=O)CBr

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ECE1 P42892 2/20 0.50
PRMT1 Q99873 1/20 0.47
HDAC3 O15379 2/20 0.39
HDAC4 P56524 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
EGLN1 Q9GZT9 2/20 0.38
KDM4E B2RXH2 2/20 0.38
KDM5C P41229 2/20 0.38
PHF8 Q9UPP1 2/20 0.38
KDM2A Q9Y2K7 2/20 0.38
KDM6B O15054 1/20 0.38
FOLH1 Q04609 1/20 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
SCHEMBL2032064 0.91 ECE1 (0.58) ECE1PRMT1HDAC3HDAC4HDAC1
SCHEMBL16938643 0.82 PRMT1 (0.64) ECE1PRMT1EGLN1KDM4ELMNA
SCHEMBL10866810 0.79 HDAC3 (0.41) ECE1HDAC3HDAC4HDAC1HDAC7
SCHEMBL8735106 0.78 ATM (0.52) ECE1PRMT1HDAC3HDAC4HDAC1
SCHEMBL8531287 0.77 ECE1 (0.62) ECE1EGLN1KDM4EKDM5CPHF8
SCHEMBL10897119 0.77 PRMT1 (0.59) PRMT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL3267882 0.75 PRMT1 (0.63) PRMT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL23567380 0.75 PRMT1 (0.63) PRMT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL23567470 0.75 PRMT1 (0.63) PRMT1HDAC3HDAC4HDAC1HDAC7
SCHEMBL1276363 0.75 HDAC3 (0.41) ECE1HDAC3HDAC4HDAC1HDAC7

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-3912982-A1 NOVEL HYDROPHILIC LINKERS AND LIGAND-DRUG CONJUGATES THEREOF Hangzhou Dac Biotech Co., Ltd (CN) 2021-11-24 EP disclosed
EP-3271329-B1 NOVEL HYDROPHILIC LINKERS AND LIGAND-DRUG CONJUGATES THEREOF HANGZHOU DAC BIOTECH CO LTD (CN) 2021-08-18 EP disclosed