SCHEMBL10698386

SCHEMBL10698386

CC(=O)C(=Cc1ccccc1)O[PH](=O)OC(=Cc1ccccc1)C(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 1/20 0.48
RECQL P46063 1/20 0.46
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
HTT P42858 1/20 0.41
FBP1 P09467 1/20 0.41
GLA P06280 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
ABCG2 Q9UNQ0 1/20 0.39
AKR1C1 Q04828 1/20 0.39
MAPT P10636 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MTNR1A P48039 2/20 0.38
MTNR1B P49286 2/20 0.38
POLB P06746 2/20 0.38
L3MBTL1 Q9Y468 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
SCHEMBL10698378 1.00 AKR1C3 (0.48) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL10698381 0.88 AKR1C3 (0.47) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL7298993 0.79 RECQL (0.55) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL5047540 0.79 RECQL (0.55) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL7298723 0.76 AKR1C3 (0.50) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL7298719 0.76 AKR1C3 (0.50) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL30937972 0.73 AKR1C3 (0.55) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL10348183 0.72 RECQL (0.51) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL10348187 0.72 RECQL (0.51) AKR1C3RECQLALDH1A1TSHRMEN1
SCHEMBL11836294 0.71 AKR1C3 (0.44) AKR1C3RECQLALDH1A1TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0276000-A2 Process for producing alpha-(benzylidene)-acetonylphosphonates NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-07-27 EP claimed
EP-0276000-A2 Process for producing alpha-(benzylidene)-acetonylphosphonates NISSAN CHEMICAL INDUSTRIES LTD. (JP) 1988-07-27 EP disclosed