Syringol

Syringol

SCHEMBL7939382

C1=CC([Hf+2]C2C=Cc3ccccc32)c2ccccc21.COc1cccc(OC)c1[O-].COc1cccc(OC)c1[O-]

nearest known ligand 0.34

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
ALDH1A1 P00352 4/20 0.33
HTT P42858 2/20 0.33
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
HTR2C P28335 3/20 0.33
MAPK1 P28482 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
POLL Q9UGP5 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32

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
Syringol SCHEMBL7942003 0.79 MEN1 (0.35) CA12CA1CA2CA4CA7
Syringol SCHEMBL7939505 0.79 CA12 (0.34) CA12CA1CA2CA4CA7
Syringol SCHEMBL7937075 0.77 HTR2C (0.34) CA12CA1CA2CA4CA7
SCHEMBL4576220 0.77 HTR2A (0.39) KDM4EHTR2CMEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL29573673 0.77 HTR2A (0.39) KDM4EHTR2CMEN1KMT2ASMN1; SMN2
Fluoride Ion SCHEMBL7641581 0.77 HTR2A (0.39) KDM4EHTR2CMEN1KMT2ASMN1; SMN2
Hydrochloric Acid SCHEMBL819246 0.77 HTR2A (0.39) KDM4EHTR2CMEN1KMT2ASMN1; SMN2
Syringol SCHEMBL7930355 0.75 KDM4E (0.33) CA12CA1CA2CA4CA7
Hydrochloric Acid SCHEMBL8713393 0.75 HTR2A (0.38) KDM4EHTR2CMEN1KMT2ASMN1; SMN2
Ethylene SCHEMBL2879207 0.73 HTR2A (0.36) KDM4EHTR2CHTR2ASLC6A2SLC6A3

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-6281320-B1 POLYOLEFIN CATALYST UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION 2001-08-28 US disclosed