SCHEMBL28150348

SCHEMBL28150348

CCCCC(CC)COP(=O)(OC)c1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
ALDH1A1 P00352 5/20 0.48
CA2 P00918 1/20 0.48
LMNA P02545 3/20 0.44
PRSS1 P07477 1/20 0.43
PRSS2 P07478 1/20 0.43
PRSS3 P35030 1/20 0.43
MAPK1 P28482 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 1/20 0.41
KDM4E B2RXH2 1/20 0.38
TSHR P16473 2/20 0.38
HSD17B10 Q99714 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
ATM Q13315 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL7547579 0.93 CYP3A4 (0.58) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL7897341 0.86 L3MBTL1 (0.51) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL8862368 0.84 CYP3A4 (0.58) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL3463190 0.83 CYP3A4 (0.45) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL28240596 0.83 CYP3A4 (0.57) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL5495795 0.82 CYP3A4 (0.55) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL3463207 0.81 PRSS1 (0.46) CYP3A4L3MBTL1ALDH1A1CA2PRSS1
SCHEMBL3463548 0.81 PRSS1 (0.46) CYP3A4L3MBTL1ALDH1A1CA2PRSS1
SCHEMBL7540441 0.78 CYP3A4 (0.51) CYP3A4L3MBTL1ALDH1A1CA2LMNA
SCHEMBL4713067 0.78 L3MBTL1 (0.59) CYP3A4L3MBTL1ALDH1A1CA2LMNA

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-106795719-A Antiflaming floor material and its manufacture method 乐金华奥斯株式会社 2017-05-31 CN disclosed