SCHEMBL9291069

SCHEMBL9291069

CC(C)(C)OP(=O)(CCC(=O)Oc1ccccc1C(C)(C)C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.44
ATM Q13315 1/20 0.44
NPSR1 Q6W5P4 2/20 0.42
KDM4E B2RXH2 4/20 0.41
ALDH1A1 P00352 4/20 0.41
GAA P10253 3/20 0.41
NAMPT P43490 1/20 0.39
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
BCHE P06276 1/20 0.38
RBP4 P02753 2/20 0.37
ALOX15 P16050 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
RECQL P46063 1/20 0.36
MAPT P10636 1/20 0.36
POLB P06746 2/20 0.35
PKM P14618 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL9290952 0.84 ALDH1A1 (0.47) TDP1ATMNPSR1KDM4EALDH1A1
SCHEMBL9291073 0.81 MAPT (0.47) TDP1NPSR1ALDH1A1GAAMEN1
SCHEMBL16046169 0.80 POLB (0.40) NPSR1ALDH1A1GAAMEN1KMT2A
SCHEMBL28225367 0.79 NPSR1 (0.45) NPSR1ALDH1A1GAAMEN1KMT2A
SCHEMBL27670207 0.76 TDP1 (0.55) TDP1ATMNPSR1KDM4EALDH1A1
SCHEMBL12379209 0.74 ATM (0.53) TDP1ATMNPSR1KDM4EALDH1A1
SCHEMBL1205809 0.72 TDP1 (0.57) TDP1ATMNPSR1KDM4EALDH1A1
SCHEMBL10774513 0.71 SMN1; SMN2 (0.40) ATMNPSR1ALDH1A1GAAMEN1
SCHEMBL1205811 0.71 TDP1 (0.56) TDP1ATMNPSR1KDM4EALDH1A1
SCHEMBL1791077 0.71 TDP1 (0.55) TDP1ATMNPSR1KDM4EALDH1A1

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
US-5334760-A Reacting a dichlorophosphine compound with acrylic acid or methacrylic acid in presence of a peroxide or an azo catalysts then hydration SAKAI CHEMICAL INDUSTRY CO., LTD. (JP) 1994-08-02 US disclosed