SCHEMBL2356853

SCHEMBL2356853

COC(=O)/C(=C/C(=O)O[SiH3])c1ccccc1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.40
NPC1 O15118 2/20 0.40
HPGD P15428 2/20 0.40
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
KMT2A Q03164 3/20 0.37
MEN1 O00255 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
KCNK3 O14649 1/20 0.37
POLB P06746 1/20 0.37
KCNK9 Q9NPC2 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
MYC P01106 1/20 0.36
MAPK1 P28482 1/20 0.36
GAA P10253 1/20 0.36
DHODH Q02127 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 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
SCHEMBL5998811 0.82 NPC1 (0.45) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL9723735 0.82 NPC1 (0.45) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL8461319 0.80 NPC1 (0.44) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL1426456 0.80 NPC1 (0.44) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL1426457 0.80 NPC1 (0.44) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL13808860 0.80 NPC1 (0.39) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL1426474 0.79 NPC1 (0.43) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL5998808 0.79 NPC1 (0.43) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL1426471 0.79 NPC1 (0.43) RAB9ANPC1HPGDERCC5FEN1
SCHEMBL10353055 0.79 TSHR (0.48) RAB9ANPC1HPGDERCC5FEN1

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-2011092143-A1 ANTIFOULING COMPOSITION JOTUN A/S (NO) 2011-08-04 WO disclosed