SCHEMBL24866254

SCHEMBL24866254

COC(=O)[C@@H](CCl)NC(C)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42
ALOX15 P16050 1/20 0.42
NFKB1 P19838 1/20 0.42
PTGS2 P35354 1/20 0.42
THPO P40225 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
ALDH1A1 P00352 2/20 0.41
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA3 P07451 1/20 0.36
CA4 P22748 1/20 0.36
CA6 P23280 1/20 0.36
CA5A P35218 1/20 0.36
CA7 P43166 1/20 0.36
CACNA1C Q13936 1/20 0.36

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
SCHEMBL1812110 1.00 SMN1; SMN2 (0.42) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL4028312 1.00 SMN1; SMN2 (0.42) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL6247529 0.83 CAD (0.43) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL22207692 0.83 KDM4E (0.39) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL12064309 0.82 SMN1; SMN2 (0.45) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL12064029 0.82 SMN1; SMN2 (0.45) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL12064041 0.82 SMN1; SMN2 (0.45) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL13611400 0.81 KDM4E (0.41) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL5808266 0.80 TGFBR1 (0.44) SMN1; SMN2KDM4EMAPTTHRBALOX15
SCHEMBL4659641 0.80 SMN1; SMN2 (0.43) SMN1; SMN2KDM4EMAPTTHRBALOX15

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023280280-A1 FUSED-RING COMPOUND THAT ACTS AS KRAS G12D INHIBITOR 微境生物医药科技(上海)有限公司 2023-01-12 WO disclosed
CN-104710324-B A kind of method synthesizing scheme for lacosamide 华润双鹤药业股份有限公司 2016-08-31 CN disclosed
CN-104710324-A Lacosamide synthesis method CHINA RESOURCES DOUBLE CRANE PHARMACEUTICAL CO LTD 2015-06-17 CN disclosed