SCHEMBL4451527

SCHEMBL4451527

CCc1cc(Cc2cc(CC)cc(C(C)(C)C)c2OP(=O)(O)O)c(OP(=O)(O)O)c(C(C)(C)C)c1.[LiH]

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 2/20 0.53
HMGCR P04035 3/20 0.35
INPPL1 O15357 6/20 0.33
INPP5A Q14642 5/20 0.33
SRC P12931 2/20 0.33
CYP2C19 P33261 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
BLM P54132 1/20 0.33
AKT1 P31749 1/20 0.32
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
DHFR P00374 1/20 0.31
INPP5B P32019 2/20 0.31
CYP2C9 P11712 1/20 0.30
HIF1A Q16665 1/20 0.30
NR1I2 O75469 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
SCHEMBL4957599 0.99 HSPA5 (0.54) HSPA5HMGCRINPPL1INPP5ASRC
SCHEMBL4453501 0.97 HSPA5 (0.53) HSPA5HMGCRINPPL1INPP5ASRC
Phosphoric Acid SCHEMBL27740009 0.86 HSPA5 (0.44) HSPA5HMGCRINPPL1INPP5ASRC
SCHEMBL1132177 0.82 INPPL1 (0.35) HSPA5HMGCRINPPL1INPP5ASRC
SCHEMBL4453668 0.82 HSPA5 (0.50) HSPA5INPPL1INPP5ASRCCYP2C19
SCHEMBL4445845 0.82 INPPL1 (0.39) HSPA5INPPL1INPP5ASRCCYP2C19
SCHEMBL29612109 0.81 INPPL1 (0.36) HSPA5HMGCRINPPL1INPP5ASRC
SCHEMBL2334329 0.81 INPPL1 (0.36) HSPA5HMGCRINPPL1INPP5ASRC
SCHEMBL888647 0.79 INPPL1 (0.35) HSPA5HMGCRINPPL1INPP5ASRC
SCHEMBL20299533 0.79 INPPL1 (0.35) HSPA5HMGCRINPPL1INPP5ASRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7531605-B2 Process for producing polyolefin resin composition and polypropylene composition IDEMITSU KOSAN CO., LTD. (JP) 2009-05-12 US disclosed
EP-1375538-B1 PROCESS FOR PRODUCING POLYOLEFIN RESIN COMPOSITION AND POLYPROPYLENE COMPOSITION IDEMITSU KOSAN CO (JP) 2008-01-09 EP disclosed
US-20040106738-A1 Process for producing polyolefin resin composition and polypropylene composition IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-06-03 US disclosed
EP-1375538-A1 PROCESS FOR PRODUCING POLYOLEFIN RESIN COMPOSITION AND POLYPROPYLENE COMPOSITION IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2004-01-02 EP disclosed