SCHEMBL9709482

SCHEMBL9709482

C[Si](C)(C)C(C(=O)O)=C(CC1CCCCC1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.38
KMT2A Q03164 2/20 0.38
EPHX1 P07099 1/20 0.38
EPHX2 P34913 3/20 0.36
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
SLC1A3 P43003 2/20 0.33
SLC1A2 P43004 2/20 0.33
SLC1A1 P43005 2/20 0.33
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
ALPL P05186 1/20 0.32
LMNA P02545 1/20 0.32
CYP2D6 P10635 1/20 0.32
KDM4E B2RXH2 1/20 0.31

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
SCHEMBL31343209 0.73 KMT2A (0.38) HPGDKMT2AEPHX1EPHX2NPC1
SCHEMBL998084 0.72 EPHX1 (0.41) HPGDKMT2AEPHX1EPHX2NPC1
SCHEMBL8415539 0.72 EPHX1 (0.41) HPGDKMT2AEPHX1EPHX2NPC1
SCHEMBL28785459 0.69 EPHX1 (0.38) HPGDKMT2AEPHX1EPHX2NPC1
SCHEMBL9709220 0.68 CES2 (0.39) HPGDKMT2ANPC1RAB9AMEN1
SCHEMBL9709236 0.68 CES2 (0.39) HPGDKMT2ANPC1RAB9AMEN1
SCHEMBL9709161 0.68 FFAR3 (0.36)
SCHEMBL9709143 0.68 FFAR3 (0.36)
SCHEMBL3871573 0.68 EPHX1 (0.48) HPGDKMT2AEPHX1EPHX2NPC1
SCHEMBL5711897 0.67 EPHX1 (0.52) HPGDKMT2AEPHX1EPHX2NPC1

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
EP-0244835-B1 LANGMUIR-BLODGETT ULTRATHIN MEMBRANE OF POLYFUMURATE NIPPON OIL AND FATS COMPANY, LIMITED (JP) 1992-08-26 EP claimed