SCHEMBL8322218

SCHEMBL8322218

CCCCCC1CCC(C(=O)Cc2c(CC)cc3c(OCc4ccccc4)cccn23)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 3/20 0.38
NPC1 O15118 3/20 0.35
MAPK8 P45983 1/20 0.35
MAPK9 P45984 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
RAB9A P51151 2/20 0.35
ATP4A P20648 1/20 0.35
ATP4B P51164 1/20 0.35
PKM P14618 1/20 0.35
TRPM8 Q7Z2W7 1/20 0.35
ABL1 P00519 1/20 0.34
RIN1 Q13671 1/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
PLG P00747 1/20 0.34
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
PRSS3 P35030 1/20 0.34
IDH1 O75874 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
SCHEMBL7014370 0.87 PLA2G1B (0.41) PLA2G1BMEN1KMT2AATP4AATP4B
SCHEMBL7012019 0.83 PLA2G1B (0.38) PLA2G1BNPC1MAPK8MAPK9MEN1
SCHEMBL7014264 0.78 PLA2G1B (0.42) PLA2G1BMEN1KMT2AATP4AATP4B
SCHEMBL7013631 0.77 ATP4A (0.42) PLA2G1BNPC1MEN1KMT2ARAB9A
SCHEMBL8321751 0.77 L3MBTL1 (0.46) PLA2G1BNPC1MEN1KMT2ARAB9A
SCHEMBL7011801 0.76 PLA2G1B (0.45) PLA2G1BMEN1KMT2AATP4AATP4B
SCHEMBL7006126 0.75 PLA2G1B (0.46) PLA2G1BMEN1KMT2AATP4AATP4B
SCHEMBL7011597 0.74 ATP4A (0.44) PLA2G1BMEN1KMT2AATP4AATP4B
SCHEMBL7009138 0.73 ALDH1A1 (0.42) PLA2G1BNPC1MAPK8MAPK9MEN1
SCHEMBL7013513 0.72 SGMS2 (0.43) PLA2G1BNPC1MAPK8MAPK9MEN1

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
EP-0772596-A4 INDOLIZINE sPLA2 INHIBITORS LILLY CO ELI (US) 1999-01-13 EP disclosed
EP-0772596-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1997-05-14 EP disclosed