SCHEMBL25977351

SCHEMBL25977351

CC(C)(C)OC(=O)CCC(NC(=O)CN)C(N)=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
NOD1 Q9Y239 1/20 0.36
CTSK P43235 3/20 0.33
CYP2D6 P10635 1/20 0.33
REN P00797 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
P2RY12 Q9H244 4/20 0.32
ACE P12821 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
SCHEMBL20710289 0.88 L3MBTL1 (0.45) L3MBTL1KMT2APOLBCTSKCYP2D6
SCHEMBL26123298 0.88 NOD1 (0.40) L3MBTL1KMT2APOLBNOD1ACE
SCHEMBL24204924 0.88 L3MBTL1 (0.45) L3MBTL1KMT2APOLBCTSKCYP2D6
SCHEMBL26123291 0.88 NOD1 (0.40) L3MBTL1KMT2APOLBNOD1ACE
SCHEMBL14539642 0.84 CTSK (0.47) CTSKCYP2D6RENCYP1A2CYP2C9
SCHEMBL14539748 0.84 CTSK (0.47) CTSKCYP2D6RENCYP1A2CYP2C9
SCHEMBL27541323 0.84 CTSK (0.47) CTSKCYP2D6RENCYP1A2CYP2C9
SCHEMBL31228993 0.84 L3MBTL1 (0.60) L3MBTL1KMT2APOLBNOD1CTSK
SCHEMBL20341530 0.83 L3MBTL1 (0.41) L3MBTL1KMT2APOLBCTSKCYP2D6
SCHEMBL13711118 0.81 CTSK (0.33) L3MBTL1KMT2APOLBCTSKCYP2D6

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-3220956-B1 CONJUGATES AND CONJUGATING REAGENTS ABZENA UK LTD (GB) 2023-08-09 EP disclosed