SCHEMBL27296339

SCHEMBL27296339

COC(=O)C(C)Oc1cccc(O)c1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F9 P00740 1/20 0.46
PLAU P00749 1/20 0.46
KMT2A Q03164 1/20 0.42
CA1 P00915 4/20 0.42
CA2 P00918 4/20 0.42
CA12 O43570 3/20 0.42
CA7 P43166 3/20 0.42
CA9 Q16790 3/20 0.42
CA14 Q9ULX7 3/20 0.42
ALDH1A1 P00352 5/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
HPGD P15428 5/20 0.39
HSD17B10 Q99714 3/20 0.39
MAPK1 P28482 2/20 0.39
TP53 P04637 2/20 0.39
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
MAPT P10636 1/20 0.39

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
SCHEMBL27647162 0.86 KDM4E (0.49) KMT2ACA1CA2CA12CA7
SCHEMBL7812520 0.85 KMT2A (0.50) F9PLAUKMT2ACA1CA2
SCHEMBL10975368 0.83 F9 (0.48) F9PLAUKMT2AALDH1A1KDM4E
SCHEMBL17847150 0.83 F9 (0.48) F9PLAUKMT2AALDH1A1KDM4E
SCHEMBL9711019 0.83 F9 (0.51) F9PLAUKMT2ACA1CA2
SCHEMBL10974859 0.80 F9 (0.43) F9PLAUKMT2AALDH1A1KDM4E
SCHEMBL27260575 0.79 F9 (0.50) F9PLAUKMT2ACA1CA2
SCHEMBL21415510 0.78 HPGD (0.56) F9PLAUKMT2AALDH1A1KDM4E
SCHEMBL20097882 0.78 HPGD (0.56) F9PLAUKMT2AALDH1A1KDM4E
SCHEMBL10976293 0.78 GLA (0.51) KMT2AALDH1A1KDM4EGAASMN1; SMN2

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
CN-1035434-C Herbicidal 2-[(4-heterocyclic-phenoxymethyl) phenoxy]-alkanoates FMC CORP (US) 1997-07-16 CN disclosed
CN-1083479-A 2-[(4-heterocycle-phenoxymethyl) phenoxy group] the alkanoates weedicide FMC CORP (US) 1994-03-09 CN disclosed