SCHEMBL27397232

SCHEMBL27397232

CCOC(=O)C(CCC=O)(c1ccccc1)P(=O)(OC)OC

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
PIN1 Q13526 1/20 0.39
POLB P06746 3/20 0.38
MMP8 P22894 1/20 0.38
ATM Q13315 1/20 0.37
AOX1 Q06278 1/20 0.37
MAPT P10636 3/20 0.35
ALDH1A1 P00352 2/20 0.35
CACNA1G O43497 1/20 0.35
RECQL P46063 1/20 0.35
LMNA P02545 1/20 0.35
KCNN4 O15554 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 1/20 0.34
MAPK1 P28482 1/20 0.34
THRB P10828 1/20 0.34

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
SCHEMBL27398528 0.85 KCNN4 (0.36) SMN1; SMN2POLBAOX1MAPTALDH1A1
SCHEMBL27602915 0.75 PIN1 (0.43) SMN1; SMN2PIN1POLBMMP8ATM
SCHEMBL27535328 0.75 KCNN4 (0.36) SMN1; SMN2MAPTALDH1A1CACNA1GLMNA
SCHEMBL21119495 0.74 PIN1 (0.42) SMN1; SMN2PIN1POLBMMP8ATM
SCHEMBL21119496 0.73 PIN1 (0.41) SMN1; SMN2PIN1POLBMMP8MAPT
SCHEMBL11578597 0.73 SMN1; SMN2 (0.49) SMN1; SMN2PIN1POLBMMP8ATM
SCHEMBL2352709 0.69 ALDH1A1 (0.51) SMN1; SMN2PIN1POLBMMP8ALDH1A1
SCHEMBL8796326 0.69 SMN1; SMN2 (0.46) SMN1; SMN2PIN1POLBMMP8ATM
SCHEMBL8767191 0.69 SMN1; SMN2 (0.51) SMN1; SMN2PIN1POLBMMP8ATM
SCHEMBL10577078 0.68 PIN1 (0.47) SMN1; SMN2PIN1POLBMMP8MAPT

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
CN-1086218-A Anti-inflammatory agent phosphine acyl acetic acid ester and acid UPJOHN CO (US) 1994-05-04 CN claimed