SCHEMBL27477607

SCHEMBL27477607

O=C(O)COCCc1cccn2cccc12

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 3/20 0.42
FFAR4 Q5NUL3 8/20 0.38
ALOX15 P16050 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HRH1 P35367 2/20 0.32
SLC6A2 P23975 1/20 0.32
HRH2 P25021 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32
DRD3 P35462 1/20 0.32
HTR2B P41595 1/20 0.32
SLC6A3 Q01959 1/20 0.32
TEK Q02763 1/20 0.32
KCNH2 Q12809 1/20 0.32
USP2 O75604 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
PTGS2 P35354 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL8916169 0.74 AKR1B1 (0.50) TBXAS1TDP1PTGS2KMT2A
SCHEMBL4398478 0.72 KDM4E (0.46) FFAR4ALOX15L3MBTL1PTGS2KMT2A
SCHEMBL16542334 0.72 FFAR4 (0.40) FFAR4ALOX15L3MBTL1
SCHEMBL13886094 0.72 TAAR1 (0.46) FFAR4MEN1KMT2A
SCHEMBL3891807 0.72 KMT2A (0.47) L3MBTL1USP2KMT2A
SCHEMBL7013247 0.70 L3MBTL1 (0.51) TBXAS1ALOX15L3MBTL1TDP1MEN1
SCHEMBL3082606 0.70 POLB (0.56) L3MBTL1MEN1KMT2A
SCHEMBL3897629 0.70 KMT2A (0.49) USP2PTGS2MEN1KMT2A
SCHEMBL48684 0.70 TDP1 (0.57) FFAR4TDP1
SCHEMBL28430477 0.70 MCL1 (0.60) TBXAS1KMT2A

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
CN-1158121-A Indolizine sPLA2Inhibitors LILLY CO ELI (US) 1997-08-27 CN disclosed