SCHEMBL4453764

SCHEMBL4453764

Cc1cc(C)c(OP(=O)(O)O)c(Cc2cc(C)cc(C)c2OP(=O)(O)O)c1.[NaH]

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 2/20 0.49
INPPL1 O15357 8/20 0.39
INPP5A Q14642 5/20 0.38
AKT1 P31749 1/20 0.37
INPP5B P32019 2/20 0.36
PGK1 P00558 3/20 0.35
PGK2 P07205 3/20 0.35
BLM P54132 1/20 0.34
ALDH1A1 P00352 1/20 0.33
CYP3A4 P08684 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
AMY1A P0DUB6 1/20 0.33
HSPA5 P11021 1/20 0.33
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
HIF1A Q16665 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL10940975 0.85 SRC (0.45) SRCINPPL1INPP5AINPP5BCYP3A4
SCHEMBL5074713 0.83 SRC (0.66) SRCINPPL1INPP5AAKT1INPP5B
SCHEMBL4447599 0.81 HSPA5 (0.50) SRCINPPL1INPP5AAKT1PGK1
SCHEMBL4453668 0.78 HSPA5 (0.50) SRCINPPL1INPP5AAKT1PGK1
SCHEMBL11321233 0.73 HSPA5 (0.65) SRCALDH1A1AMY1AHSPA5CYP2D6
SCHEMBL4445845 0.72 INPPL1 (0.39) SRCINPPL1INPP5AAKT1INPP5B
SCHEMBL4443868 0.72 SRC (0.42) SRCINPPL1INPP5AAKT1INPP5B
SCHEMBL8388017 0.71 SRC (0.60) SRCINPPL1INPP5AAKT1INPP5B
SCHEMBL29742222 0.71 SRC (0.50) SRCINPPL1INPP5AINPP5BPGK1
SCHEMBL10942720 0.71 SRC (0.47) SRCINPPL1INPP5AAKT1INPP5B

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