SCHEMBL6270867

SCHEMBL6270867

CCNS(=O)(=O)c1ccc2c(c1)NC(=O)c1c(O)cccc1O2

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.40
ABL1 P00519 3/20 0.40
BRD4 O60885 1/20 0.40
PKM P14618 3/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
OPRM1 P35372 1/20 0.38
OPRD1 P41143 1/20 0.38
ALDH1A1 P00352 5/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
PNMT P11086 1/20 0.34

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
SCHEMBL6272881 0.84 ABL1 (0.38) SMN1; SMN2ABL1MEN1KMT2ALMNA
SCHEMBL6267336 0.81 ABL1 (0.48) ABL1MEN1KMT2AALDH1A1LMNA
SCHEMBL8333095 0.75 TP53 (0.43) LMNAMAPT
SCHEMBL6266752 0.74 EGFR (0.48) SMN1; SMN2MEN1KMT2AALDH1A1KDM4E
SCHEMBL6184354 0.74 AHR (0.40) MEN1KMT2AMAPT
SCHEMBL6273613 0.74 ALOX5 (0.38) ABL1MAPT
SCHEMBL8321281 0.73 ALOX5 (0.65) SMN1; SMN2ABL1MEN1KMT2AALDH1A1
SCHEMBL8333850 0.72 ALOX5 (0.62) SMN1; SMN2ABL1MEN1KMT2AALDH1A1
SCHEMBL6256089 0.71 ABL1 (0.41) ABL1
SCHEMBL6274420 0.70 ALOX5 (0.42) ABL1MEN1KMT2APOLBMAPT

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
WO-2005072741-A1 ((11-OXO-10,11-DIHYDRODIBENZO [B, F] [1, 4] OXAZEPIN-1-YL)OXY) ACETIC ACID DERIVATIVES AND RELATED COMPOUNDS AS CARDIOVASCULAR PREPARATIONS USED TO TREAT ARTERIOLOSCLEROSIS BAYER HEALTHCARE AG (DE) 2005-08-11 WO disclosed
WO-2005072741-A1 ((11-OXO-10,11-DIHYDRODIBENZO [B, F] [1, 4] OXAZEPIN-1-YL)OXY) ACETIC ACID DERIVATIVES AND RELATED COMPOUNDS AS CARDIOVASCULAR PREPARATIONS USED TO TREAT ARTERIOLOSCLEROSIS BAYER HEALTHCARE AG (DE) 2005-08-11 WO disclosed