SCHEMBL269493

SCHEMBL269493

O=[PH](OCC(CO)(CO)CO[PH](=O)Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
RECQL P46063 1/20 0.33
ALOX15 P16050 1/20 0.32
LTA4H P09960 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
ALPL P05186 1/20 0.30
ALPI P09923 1/20 0.30
ALPG P10696 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
SCHEMBL27602276 0.80 ALDH1A1 (0.39) ALDH1A1RECQLALOX15LTA4HMEN1
SCHEMBL10825633 0.79 RIPK1 (0.36) ALDH1A1ALOX15LTA4HMEN1KMT2A
SCHEMBL28016039 0.77 ALDH1A1 (0.50) ALDH1A1RECQLALOX15LTA4HMEN1
SCHEMBL13412437 0.75 LTA4H (0.36) ALDH1A1RECQLALOX15LTA4HMEN1
SCHEMBL23573053 0.75 ALDH1A1 (0.48) ALDH1A1RECQLALOX15LTA4HMEN1
Biphenyl SCHEMBL2047773 0.74 MAPK1 (0.34) ALDH1A1MAPK1HIF1ARECQLKDM4E
Alcohol SCHEMBL3197317 0.74 RECQL (0.40) ALDH1A1RECQLALOX15LTA4HMEN1
SCHEMBL29223949 0.72 ALDH1A1 (0.41) ALDH1A1RECQLMEN1KMT2AALPL
SCHEMBL20943 0.72 LTA4H (0.45) ALOX15LTA4HCYP2C9CYP2C19
Benzene SCHEMBL11134259 0.72 LTA4H (0.45) ALOX15LTA4HCYP2C9CYP2C19

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-8133835-B2 Molecular weight controllable, high 1,4-trans polybutadiene catalyst system KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2012-03-13 US disclosed
US-20100261847-A1 MOLECULAR WEIGHT CONTROLLABLE, HIGH 1,4-TRANS POLYBUTADIENE CATALYST SYSTEM KOREA KUMHO PETROCHEMICAL CO., LTD. (KR) 2010-10-14 US disclosed