SCHEMBL9498600

SCHEMBL9498600

CC(c1ccccc1)c1c(O)cccc1Cc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 1/20 0.46
BCL2L1 Q07817 1/20 0.46
KEAP1 Q14145 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
ALOX5 P09917 1/20 0.41
POLB P06746 2/20 0.41
MAPK1 P28482 1/20 0.41
MEN1 O00255 1/20 0.39
CYP3A4 P08684 1/20 0.39
HPGD P15428 1/20 0.39
ALOX15 P16050 1/20 0.39
KMT2A Q03164 1/20 0.39
HIF1A Q16665 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TYR P14679 1/20 0.39
KCNMA1 Q12791 1/20 0.38
HSPA5 P11021 1/20 0.38
ELANE P08246 1/20 0.38
CTSG P08311 1/20 0.38
LDHA P00338 1/20 0.37

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
SCHEMBL6910777 0.84 TYR (0.39) BCL2BCL2L1POLBMAPK1MEN1
SCHEMBL661820 0.80 TYR (0.50) L3MBTL1POLBMEN1CYP3A4HPGD
SCHEMBL25266353 0.80 TYR (0.50) L3MBTL1POLBMEN1CYP3A4HPGD
SCHEMBL27802158 0.78 BID (0.46) BCL2L1ALOX15HSD17B10TYR
SCHEMBL9418836 0.78 TYR (0.44) L3MBTL1POLBMEN1CYP3A4HPGD
SCHEMBL28318581 0.77 BID (0.51) BCL2L1ALOX5ALOX15HSD17B10
SCHEMBL9496068 0.74 TYR (0.52) MEN1CYP3A4HPGDALOX15KMT2A
SCHEMBL292194 0.74 TYR (0.53) POLBMEN1CYP3A4HPGDALOX15
SCHEMBL11302263 0.74 ALDH1A1 (0.46) POLBMEN1CYP3A4HPGDALOX15
SCHEMBL4657385 0.74 L3MBTL1 (0.44) BCL2BCL2L1L3MBTL1TYR

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-0310973-B1 LEVELLING AGENT BAYER AG (DE) 1993-05-12 EP disclosed