Catechol

Catechol

SCHEMBL7060022

NP(O)O.Oc1ccccc1O

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.67
HPGD P15428 4/20 0.67
HSD17B10 Q99714 4/20 0.67
CA2 P00918 4/20 0.67
ALOX15 P16050 3/20 0.67
LMNA P02545 3/20 0.67
KDM4E B2RXH2 3/20 0.67
MAPT P10636 3/20 0.67
TDP1 Q9NUW8 3/20 0.67
EGFR P00533 2/20 0.67
FYN P06241 2/20 0.67
MMP9 P14780 2/20 0.67
RECQL P46063 2/20 0.67
NPC1 O15118 2/20 0.67
CA4 P22748 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
CA12 O43570 1/20 0.67
GMNN O75496 1/20 0.67
POLB P06746 1/20 0.67
CA3 P07451 1/20 0.67

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
Catechol SCHEMBL9239332 0.86 ALDH1A1 (0.77) ALDH1A1HPGDHSD17B10CA2ALOX15
Catechol SCHEMBL7725837 0.86 ALDH1A1 (0.77) ALDH1A1HPGDHSD17B10CA2ALOX15
Catechol SCHEMBL27770263 0.86
Catechol SCHEMBL6532255 0.82 ALDH1A1 (0.83) ALDH1A1HPGDHSD17B10CA2ALOX15
Catechol SCHEMBL29352716 0.82
Catechol SCHEMBL30088487 0.82
Catechol SCHEMBL11672589 0.82 ALDH1A1 (1.00) ALDH1A1HPGDHSD17B10CA2ALOX15
Catechol SCHEMBL367675 0.82 ALDH1A1 (1.00) ALDH1A1HPGDHSD17B10CA2ALOX15
Catechol SCHEMBL30944695 0.82 ALDH1A1 (1.00) ALDH1A1HPGDHSD17B10CA2ALOX15
Catechol SCHEMBL18351 0.82

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
WO-2003042658-A2 METHODS AND COMPOSITIONS FOR ENHANCING DETECTION IN DETERMINATIONS EMPLOYING CLEAVABLE ELECTROPHORETIC TAG REAGENTS ACLARA BIOSCIENCES, INC. (US) 2003-05-22 WO disclosed