SCHEMBL7949634

SCHEMBL7949634

CC(C)CCCCCc1ccc(OP(O)F)c(CCCCCC(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
FUT7 Q11130 1/20 0.36
HTT P42858 3/20 0.34
MAPT P10636 2/20 0.34
MAPK1 P28482 2/20 0.34
APAF1 O14727 1/20 0.34
THRB P10828 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
NPC1 O15118 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
RAD52 P43351 1/20 0.34
CYP1A2 P05177 1/20 0.33
POLB P06746 1/20 0.33
CYP3A4 P08684 1/20 0.33

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
SCHEMBL5014067 0.88 HTT (0.40) GRIN2DGRIN2AGRIN2BGRIN2CFUT7
SCHEMBL7949239 0.85 HTT (0.47) HTTMAPTMAPK1APAF1THRB
SCHEMBL7950342 0.83 HTT (0.48) HTTMAPTMAPK1APAF1THRB
SCHEMBL28058768 0.82 HTT (0.43) HTTMAPTMAPK1APAF1THRB
SCHEMBL27456606 0.75 GRIN2D (0.36) GRIN2DGRIN2AGRIN2BGRIN2CFUT7
SCHEMBL8465007 0.74 GABRA1 (0.50) GRIN2DGRIN2AGRIN2BGRIN2CMEN1
SCHEMBL8461732 0.74 GABRA1 (0.50) GRIN2DGRIN2AGRIN2BGRIN2CMEN1
SCHEMBL10730145 0.73 HTT (0.49) HTTMAPTMAPK1APAF1THRB
SCHEMBL7949236 0.73 HTT (0.49) HTTMAPTMAPK1APAF1THRB
SCHEMBL28354766 0.73 HTT (0.49) HTTMAPTMAPK1APAF1THRB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6231804-B1 USED FOR HOLLOW CONTAINERS, A FILM, A SHEET, A PIPE, FIBER AND MOLDING;A BLEND OF HIGH MOLECULAR WEIGHT POLYETHYLENE COPOLYMER,AN OLEFIN HOMO OR COPLYMER CHISSO CORPORATION (JP) 2001-05-15 US disclosed
EP-0972800-A1 MODIFIED OLEFIN (CO)POLYMER COMPOSITION, PROCESS FOR PREPARING THE SAME, AND MODIFIED OLEFIN (CO)POLYMER COMPOSITION MOLDING CHISSO CORPORATION (JP) 2000-01-19 EP disclosed