SCHEMBL9567088

SCHEMBL9567088

CCOC(=O)C(C(=O)OCC)=P(c1ccccc1)(c1ccccc1)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
ATM Q13315 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.49
POLB P06746 1/20 0.47
TSHR P16473 2/20 0.46
GAA P10253 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HSD17B10 Q99714 1/20 0.43
KDM4E B2RXH2 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2C19 P33261 1/20 0.43
CYP19A1 P11511 1/20 0.42

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
SCHEMBL10322782 0.91 KMT2A (0.47) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL5578230 0.87 SMN1; SMN2 (0.45) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL6062364 0.86 CES2 (0.46) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL23112434 0.86 POLB (0.43) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL497796 0.86 ACHE (0.46) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL15730010 0.85 SMN1; SMN2 (0.45) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL6061172 0.85 SMN1; SMN2 (0.43) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL14511670 0.85 ALDH1A1 (0.45) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL52771 0.84 MEN1 (0.50) MEN1KMT2ASMN1; SMN2ATMNPSR1
SCHEMBL23112580 0.83 KDM4E (0.47) MEN1KMT2ASMN1; SMN2ATMNPSR1

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-0549418-A2 Unsaturated amides with pesticidal activity ROUSSEL UCLAF (FR) 1993-06-30 EP disclosed