SCHEMBL7767259

SCHEMBL7767259

CCCCc1cc(CC)ccc1OP(=O)(O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
INPPL1 O15357 6/20 0.43
INPP5A Q14642 3/20 0.43
INPP5B P32019 1/20 0.43
AKT1 P31749 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
CYP2C19 P33261 1/20 0.40
ENPP2 Q13822 1/20 0.39
PLK1 P53350 1/20 0.39
S1PR1 P21453 2/20 0.38
S1PR3 Q99500 2/20 0.38
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
HTT P42858 3/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
APAF1 O14727 1/20 0.37
THRB P10828 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
S1PR2 O95136 1/20 0.36

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
SCHEMBL6480565 0.93 INPPL1 (0.44) INPPL1INPP5AINPP5BAKT1SMN1; SMN2
SCHEMBL27778654 0.91 INPPL1 (0.43) INPPL1INPP5AINPP5BAKT1SMN1; SMN2
SCHEMBL7767258 0.88 AKT1 (0.39) AKT1SMN1; SMN2CYP2C19ENPP2HTT
SCHEMBL2865474 0.88 INPPL1 (0.47) INPPL1INPP5AINPP5BAKT1SMN1; SMN2
SCHEMBL27358737 0.86 INPPL1 (0.46) INPPL1INPP5AINPP5BAKT1SMN1; SMN2
SCHEMBL1791071 0.80 HTT (0.45) SMN1; SMN2ENPP2PLK1HTTMAPT
SCHEMBL30692697 0.80 HTT (0.45) SMN1; SMN2ENPP2PLK1HTTMAPT
SCHEMBL1100481 0.78 THRA (0.48) INPPL1INPP5AINPP5BHTR2AHTR2C
SCHEMBL31012114 0.78 THRA (0.48) INPPL1INPP5AINPP5BHTR2AHTR2C
SCHEMBL6480560 0.78 HTT (0.41) SMN1; SMN2ENPP2PLK1S1PR1S1PR3

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-1108733-A1 Propylene-ethylene block copolymer, resin composition, and blow-molded article IDEMITSU PETROCHEMICAL CO., LTD. (JP) 2001-06-20 EP disclosed