SCHEMBL10952992

SCHEMBL10952992

CC(=NO)C(=S)Oc1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.36
MAPT P10636 3/20 0.36
ALDH1A1 P00352 2/20 0.36
CA4 P22748 1/20 0.34
TDP1 Q9NUW8 2/20 0.34
KDM4E B2RXH2 1/20 0.34
HSP90AA1 P07900 1/20 0.34
GAA P10253 1/20 0.34
TAS2R38 P59533 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALOX15 P16050 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX1 P07099 1/20 0.33
CYP1A2 P05177 1/20 0.33

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
SCHEMBL3087192 0.78 LTA4H (0.45) ELANEMAPTALDH1A1CA4TDP1
SCHEMBL10952497 0.76 ELANE (0.46) ELANEMAPTALDH1A1TDP1KDM4E
SCHEMBL10952501 0.76 ELANE (0.46) ELANEMAPTALDH1A1TDP1KDM4E
SCHEMBL544813 0.75 ELANE (0.44) ELANEMAPTALDH1A1CA4TDP1
SCHEMBL8973386 0.74 ELANE (0.41) ELANEMAPTALDH1A1CA4TDP1
SCHEMBL12201346 0.74 ELANE (0.41) ELANEMAPTALDH1A1CA4TDP1
SCHEMBL761789 0.73 CA4 (0.43) ELANEMAPTALDH1A1CA4TDP1
SCHEMBL2374211 0.72 ELANE (0.42) ELANEMAPTALDH1A1CA4TDP1
SCHEMBL28597057 0.71 ELANE (0.43) ELANEMAPTALDH1A1TDP1HSP90AA1
SCHEMBL341113 0.70 TDP1 (0.47) ELANEMAPTALDH1A1TDP1KDM4E

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-4509970-A Substituted phenylphosphinyloxy- and phosphinylthio-iminocarboxylates useful for the control of weeds ZOECON CORPORATION (US) 1985-04-09 US disclosed