SCHEMBL7466860

SCHEMBL7466860

O=P(O)(F)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.62
CA4 P22748 1/20 0.62
CA5A P35218 1/20 0.62
CFTR P13569 1/20 0.54
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PTPN1 P18031 1/20 0.46
GAA P10253 2/20 0.44
USP2 O75604 1/20 0.44
ESR1 P03372 1/20 0.44
SRC P12931 2/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPT P10636 1/20 0.41
ALPG P10696 1/20 0.41
ALOX12 P18054 1/20 0.41
NPY1R P25929 1/20 0.41

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
SCHEMBL443059 0.83 CA2 (0.62) CA2CA4CA5ACFTRALOX15
Ammonia Solution, Strong SCHEMBL10908266 0.81 CA2 (0.59) CA2CA4CA5ACFTRALOX15
SCHEMBL5155948 0.78 CA2 (0.62) CA2CA4CA5ACFTRALOX15
Phenylphosphonic Acid SCHEMBL28151870 0.77 CA2 (1.00) CA2CA4CA5ACFTRALOX15
Phenylphosphonic Acid SCHEMBL34998 0.77 CA2 (1.00) CA2CA4CA5ACFTRALOX15
SCHEMBL28440014 0.77 CA2 (0.52) CA2CA4CA5ACFTRALOX15
Phenylphosphonic Acid SCHEMBL269853 0.77 CA2 (1.00) CA2CA4CA5ACFTRALOX15
SCHEMBL191567 0.77 CA2 (0.68) CA2CA4CA5ACFTRALOX15
SCHEMBL2336230 0.77 CA2 (0.52) CA2CA4CA5ACFTRALOX15
Phenylphosphonic Acid SCHEMBL11086096 0.74 CA2 (0.94) CA2CA4CA5ACFTRALOX15

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0807637-B1 Process for the preparation of tertiary phosphanes containing phosphinate or phosphonate groups and novel tertiary phosphanes containing phosphinate groups CELANESE CHEM EUROPE GMBH (DE) 2002-02-13 EP claimed
US-5801263-A Process for preparing tertiary phosphines containing phosphinate or phosphonate groups, and novel tertiary phosphines containing phosphinate groups HOECHST AKTIENGESELLSCHAFT (DE) 1998-09-01 US disclosed
EP-0807637-A1 Process for the preparation of tertiary phosphanes containing phosphinate or phosphonate groups and novel tertiary phosphanes containing phosphinate groups HOECHST AKTIENGESELLSCHAFT (DE) 1997-11-19 EP disclosed