SCHEMBL7778221

SCHEMBL7778221

COC(=O)C(=CO)c1ccccc1COc1cccc(Cl)n1

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 5/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
GAA P10253 3/20 0.38
KDM4E B2RXH2 1/20 0.38
KMT2A Q03164 1/20 0.37
TP53 P04637 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7778217 1.00 HIF1A (0.39) HIF1AL3MBTL1GAAKDM4EKMT2A
SCHEMBL7786328 0.92 HIF1A (0.40) HIF1AL3MBTL1GAAKDM4EKMT2A
SCHEMBL7786324 0.90 HIF1A (0.39) HIF1AL3MBTL1GAAKDM4EKMT2A
SCHEMBL7786334 0.90 HIF1A (0.39) HIF1AL3MBTL1GAAKDM4EKMT2A
SCHEMBL8724400 0.87 TP53 (0.41) GAAKDM4EKMT2ATP53HTT
SCHEMBL7784791 0.86 HIF1A (0.39) HIF1AKMT2AALDH1A1
SCHEMBL7784787 0.86 HIF1A (0.39) HIF1AKMT2AALDH1A1
SCHEMBL29647890 0.84 HIF1A (0.40) HIF1A
SCHEMBL7786380 0.84 HIF1A (0.40) HIF1A
SCHEMBL7786379 0.84 HIF1A (0.40) HIF1A

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-0840726-B1 PROCESS FOR THE PREPARATION OF 2-(6-SUBSTITUTED PYRID-2-YLOXYMETHYL)PHENYLACETATE SYNGENTA LTD (GB) 2001-10-10 EP disclosed
US-6015905-A REACTING OXY-METAL DERIVATIVE OF A DISUBSTITUTED PYRIDINE WITH METHYL ESTER OF PHENYLACETIC ACID(WHICH ALSO HAS ALKYL SUBSTITUENT ON RING) YIELDS INTERMEDIATE FOR PREPARATION OF AGRICULTURAL FUNGICIDES ZENECA LIMITED 2000-01-18 US disclosed