SCHEMBL8899593

SCHEMBL8899593

CCSc1ccc(C(=O)CC(=O)C2CC2)c(Cc2ccccc2)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MBTD1 Q05BQ5 1/20 0.35
L3MBTL3 Q96JM7 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
PTPN1 P18031 3/20 0.35
PTPN2 P17706 1/20 0.35
PTPN6 P29350 1/20 0.35
MCL1 Q07820 4/20 0.35
BCL2A1 Q16548 4/20 0.35
LMNA P02545 1/20 0.34
SCN1A P35498 1/20 0.34
SCN2A Q99250 1/20 0.34
SCN3A Q9NY46 1/20 0.34
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
USP2 O75604 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
ABL1 P00519 1/20 0.33
RIN1 Q13671 1/20 0.33
FFAR4 Q5NUL3 1/20 0.33

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
SCHEMBL8901745 0.88 KMT2A (0.42) MBTD1L3MBTL3L3MBTL1ALDH1A1HPGD
SCHEMBL8892557 0.78 PTPN1 (0.41) PTPN1PTPN2PTPN6MCL1BCL2A1
SCHEMBL8900596 0.78 PTPN1 (0.34) MBTD1L3MBTL3L3MBTL1PTPN1PTPN2
SCHEMBL8891189 0.77 PTPN1 (0.34) MBTD1L3MBTL3L3MBTL1PTPN1PTPN2
SCHEMBL8901043 0.76 SMN1; SMN2 (0.37) L3MBTL1LMNAUSP2ALDH1A1HPGD
SCHEMBL8891694 0.73 CCR5 (0.35) MBTD1L3MBTL3L3MBTL1PTPN1PTPN2
SCHEMBL8891490 0.73 HPGD (0.40) L3MBTL1ALDH1A1HPGD
SCHEMBL8901365 0.69 HPGD (0.43) LMNASCN1ASCN2ASCN3AALDH1A1
SCHEMBL8815619 0.68 PKM (0.36) L3MBTL1LMNAALDH1A1HPGD
SCHEMBL8815609 0.68 KMT2A (0.44) LMNACNR1CNR2ALDH1A1HDAC1

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-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed