SCHEMBL7954071

SCHEMBL7954071

Cc1ccc(CCCCCCCCOP(O)O)c(C(C)(C)C)c1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
HSPA5 P11021 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CYP2C9 P11712 2/20 0.33
CYP2C19 P33261 2/20 0.33
HIF1A Q16665 2/20 0.33
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CA2 P00918 1/20 0.32
POLB P06746 1/20 0.32
TYR P14679 1/20 0.32
USP2 O75604 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CYP2D6 P10635 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL29070983 0.92 L3MBTL1 (0.38) HTTL3MBTL1HSPA5MRGPRX4SMN1; SMN2
SCHEMBL28975262 0.92 L3MBTL1 (0.38) HTTL3MBTL1HSPA5MRGPRX4SMN1; SMN2
SCHEMBL7159711 0.86 CYP1A2 (0.33) SMN1; SMN2CYP2C19KDM4EALDH1A1CYP2D6
SCHEMBL7157824 0.86 CYP1A2 (0.33) SMN1; SMN2CYP2C19KDM4EALDH1A1CYP2D6
SCHEMBL2895917 0.86 CYP1A2 (0.33) SMN1; SMN2CYP2C19KDM4EALDH1A1CYP2D6
SCHEMBL7950344 0.86 CYP1A2 (0.33) SMN1; SMN2CYP2C19KDM4EALDH1A1CYP2D6
SCHEMBL7954073 0.77 HSPA5 (0.37) HTTL3MBTL1HSPA5MRGPRX4SMN1; SMN2
SCHEMBL28447064 0.72 ALDH1A1 (0.46) HTTHSPA5SMN1; SMN2CYP2C9CYP2C19
SCHEMBL28447062 0.72 ESR1 (0.46) HSPA5SMN1; SMN2CYP2C9CYP2C19HIF1A
SCHEMBL28959035 0.70 HSPA5 (0.39) HTTL3MBTL1HSPA5MRGPRX4SMN1; SMN2

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