SCHEMBL24909093

SCHEMBL24909093

O=C(OC(C(F)(F)F)C(F)(F)F)C(c1cccnc1)N1C(=O)c2cc(Oc3ccc(-c4ccccc4)cc3)c3c4c(Oc5ccc(-c6ccccc6)cc5)cc5c6c(cc(Oc7ccc(-c8ccccc8)cc7)c(c7c(Oc8ccc(-c9ccccc9)cc8)cc(c2c37)C1=O)c64)C(=O)N(C(C(=O)OC(C(F)(F)F)C(F)(F)F)c1cccnc1)C5=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABHD6 Q9BV23 2/20 0.38
PLA2G7 Q13093 1/20 0.38
MGLL Q99685 1/20 0.38
FFAR1 O14842 1/20 0.35
SCN9A Q15858 1/20 0.34
CHRM5 P08912 1/20 0.33
MAPK8 P45983 1/20 0.32
MAPK10 P53779 1/20 0.32
HSD17B1 P14061 1/20 0.32
HSD17B2 P37059 1/20 0.32
HSD17B4 P51659 1/20 0.32
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
MAP3K8 P41279 1/20 0.32
PSMB5 P28074 1/20 0.31
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 1/20 0.31
HCRTR1 O43613 1/20 0.30
HCRTR2 O43614 1/20 0.30

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
SCHEMBL24909002 0.87 PLA2G7 (0.31) ABHD6PLA2G7MGLL
SCHEMBL24909135 0.78 NPY2R (0.40) CHRM5CYP11B1CYP11B2PSMB5KCNA5
SCHEMBL24909034 0.77 KCNA5 (0.38) CYP11B1CYP11B2KCNA5
SCHEMBL24909304 0.74 CYP3A4 (0.37)
SCHEMBL24909194 0.73 MGLL (0.37) ABHD6MGLL
SCHEMBL24909306 0.73 MCL1 (0.33) HCRTR1
SCHEMBL24909095 0.72 POLB (0.40)
SCHEMBL24908945 0.71 TNF (0.39)
SCHEMBL24739994 0.69 KMT2A (0.41) MGLL
SCHEMBL24909279 0.68 KMT2A (0.40)

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
US-20230023648-A1 COMPOUND, PHOTOSENSITIVE FLUORESCENT RESIN COMPOSITION COMPRISING SAME, COLOR CONVERSION FILM PREPARED USING SAME, BACKLIGHT UNIT, AND DISPLAY DEVICE LG CHEM, LTD (KR) 2023-01-26 US disclosed