SCHEMBL9199334

SCHEMBL9199334

O=C(O)c1[c]c(OCc2ccccc2)ccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.47
NR4A1 P22736 1/20 0.47
NR4A3 Q92570 1/20 0.47
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
SRD5A2 P31213 2/20 0.44
P4HTM Q9NXG6 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.42
MAOB P27338 2/20 0.42
PLA2G4B P0C869 1/20 0.42
PARP10 Q53GL7 1/20 0.41
FOLH1 Q04609 1/20 0.41
LMNA P02545 2/20 0.41
HPGD P15428 1/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP1A2 P05177 1/20 0.41
PTGS1 P23219 1/20 0.41
SLC6A2 P23975 1/20 0.41
CYP2C19 P33261 1/20 0.41
PTGS2 P35354 1/20 0.41

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
SCHEMBL9199995 0.86 TDP1 (0.51) NR4A2NR4A1NR4A3KMT2ALMNA
SCHEMBL9195681 0.84 LMNA (0.54) NR4A2NR4A1NR4A3MEN1KMT2A
SCHEMBL9195029 0.82 LMNA (0.45) MEN1KMT2AMAOBLMNAHPGD
SCHEMBL3058689 0.82 MAPT (0.50) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL27716272 0.77 LMNA (0.48) NR4A2NR4A1NR4A3MEN1KMT2A
SCHEMBL17260899 0.74 MAPT (0.43) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL6195407 0.74 MAOB (0.51) MAOBLMNAHPGDCYP1A2PTGS1
SCHEMBL17260912 0.74 MAPT (0.43) MAOBLMNACYP1A2PTGS1SLC6A2
SCHEMBL7431199 0.74 MAPT (0.43) MAOBFOLH1LMNACYP1A2PTGS1
SCHEMBL7285346 0.74 L3MBTL1 (0.52) MEN1KMT2AMAOBLMNAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0687249-A1 BALANOIDS ELI LILLY AND COMPANY (US) 1995-12-20 EP claimed
WO-1994020062-A2 BALANOIDS AS PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1994-09-15 WO claimed
EP-0687249-A1 BALANOIDS ELI LILLY AND COMPANY (US) 1995-12-20 EP disclosed
WO-1994020062-A2 BALANOIDS AS PROTEIN KINASE C INHIBITORS ELI LILLY AND COMPANY (US) 1994-09-15 WO disclosed