SCHEMBL10784229

SCHEMBL10784229

O=C(NCO[PH](=O)O)C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
CA3 P07451 2/20 0.39
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
CA2 P00918 2/20 0.39
CA14 Q9ULX7 2/20 0.39
CA12 O43570 1/20 0.39
CA4 P22748 1/20 0.39
CA6 P23280 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
EPHX1 P07099 1/20 0.37

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
SCHEMBL10784226 0.85 ALDH1A1 (0.52) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL27795025 0.71
SCHEMBL7510072 0.68 ALDH1A1 (0.46) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL11048167 0.68
SCHEMBL27398724 0.68 ALDH1A1 (0.46) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL3433785 0.67 ALDH1A1 (0.67) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL3657172 0.67 TSHR (0.48) ALDH1A1
SCHEMBL24687426 0.66 ALDH1A1 (0.62) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL13861685 0.66 ALDH1A1 (0.79) ALDH1A1POLBSMN1; SMN2MEN1KMT2A
SCHEMBL2683810 0.66

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-0130008-B1 METHOD FOR PREPARATION OF N-PHOSPHONOMETHYLGLYCINE STAUFFER CHEMICAL COMPANY (US) 1987-09-09 EP disclosed