SCHEMBL9080274

SCHEMBL9080274

CCc1cc2c(OCc3ccccc3)cccn2c1C(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.45
PTGER1 P34995 1/20 0.44
MRGPRX4 Q96LA9 6/20 0.43
NR4A2 P43354 2/20 0.43
VNN1 O95497 1/20 0.43
MAOB P27338 2/20 0.43
PPIA P62937 1/20 0.43
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41
SLC1A5 Q15758 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
SCHEMBL7014844 0.88 ATM (0.48) PLA2G1BPTGER1MRGPRX4MAOB
SCHEMBL7006665 0.85 PLA2G1B (0.43) PLA2G1BPTGER1MRGPRX4NR4A2
SCHEMBL7005845 0.84 ABCB1 (0.47) PLA2G1BMRGPRX4NR4A2VNN1MAOB
SCHEMBL8323820 0.83 PLA2G1B (0.51) PLA2G1BPTGER1NR4A2MAOBPPIA
SCHEMBL8327075 0.83 PLA2G1B (0.52) PLA2G1BPTGER1MRGPRX4NR4A2VNN1
SCHEMBL8320616 0.82 MRGPRX4 (0.45) PLA2G1BPTGER1MRGPRX4FFAR4
SCHEMBL7011444 0.82 ATP4A (0.43) PLA2G1BMRGPRX4
SCHEMBL7016240 0.82 ATM (0.44) PLA2G1BPTGER1MRGPRX4
SCHEMBL8321751 0.77 L3MBTL1 (0.46) PLA2G1BPTGER1MRGPRX4
SCHEMBL7005971 0.77 MRGPRX4 (0.45) PLA2G1BMRGPRX4

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
WO-1996003383-A1 INDOLIZINE sPLA2 INHIBITORS ELI LILLY AND COMPANY (US) 1996-02-08 WO disclosed