Pyrogallol

Pyrogallol

SCHEMBL1042997

Oc1cccc(O)c1O.[PbH2]

nearest known ligand 0.92

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.92
HPGD P15428 4/20 0.92
ALOX15 P16050 4/20 0.92
HSD17B10 Q99714 4/20 0.92
LMNA P02545 3/20 0.92
CA2 P00918 3/20 0.92
RECQL P46063 3/20 0.92
TDP1 Q9NUW8 3/20 0.92
EGFR P00533 2/20 0.92
FYN P06241 2/20 0.92
MMP9 P14780 2/20 0.92
CA1 P00915 2/20 0.92
CDK2 P24941 2/20 0.92
ADAMTS4 O75173 1/20 0.92
MMP2 P08253 1/20 0.92
MMP8 P22894 1/20 0.92
CA6 P23280 1/20 0.92
MMP12 P39900 1/20 0.92
ADAMTS5 Q9UNA0 1/20 0.92
TRPA1 O75762 2/20 0.58

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
Pyrogallol SCHEMBL3532 0.96
Pyrogallol SCHEMBL170157 0.96 ALDH1A1 (1.00) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL11324823 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL11862014 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL6254002 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL4884788 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL10986410 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL442053 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL6270291 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA
Pyrogallol SCHEMBL11661058 0.92 ALDH1A1 (0.92) ALDH1A1HPGDALOX15HSD17B10LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2442667-B1 NMP-ENRICHED EXTRACT TCHIBO GMBH (DE) 2013-04-17 EP disclosed
EP-2442667-A1 NMP-ENRICHED EXTRACT Tchibo GmbH (DE) 2012-04-25 EP disclosed
EP-2269468-A1 NMP-enriched extract Tchibo GmbH (DE) 2011-01-05 EP disclosed
WO-2010145798-A1 NMP-ENRICHED EXTRACT TCHIBO GMBH (DE) 2010-12-23 WO disclosed