Catechol

Catechol

SCHEMBL9720436

Oc1ccc(O)c2ccccc12.Oc1ccccc1O

nearest known ligand 0.87

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 8/20 0.87
MAPT P10636 2/20 0.67
HPGD P15428 2/20 0.67
ALOX15 P16050 2/20 0.67
RECQL P46063 2/20 0.67
HSD17B10 Q99714 2/20 0.67
TDP1 Q9NUW8 2/20 0.67
KDM4E B2RXH2 1/20 0.67
NPC1 O15118 1/20 0.67
CA12 O43570 1/20 0.67
GMNN O75496 1/20 0.67
ALDH1A1 P00352 1/20 0.67
EGFR P00533 1/20 0.67
CA2 P00918 1/20 0.67
LMNA P02545 1/20 0.67
FYN P06241 1/20 0.67
POLB P06746 1/20 0.67
CA3 P07451 1/20 0.67
CYP3A4 P08684 1/20 0.67
MMP9 P14780 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
SCHEMBL9721905 0.93 IDO1 (0.87) IDO1MAPTHPGDALOX15RECQL
SCHEMBL32677325 0.93 IDO1 (1.00) IDO1MAPTHPGDALOX15RECQL
SCHEMBL29638 0.93 IDO1 (1.00) IDO1MAPTHPGDALOX15RECQL
SCHEMBL29362983 0.93 IDO1 (1.00) IDO1MAPTHPGDALOX15RECQL
SCHEMBL4869305 0.86 IDO1 (0.73) IDO1MAPTHPGDALOX15RECQL
SCHEMBL28327 0.86 IDO1 (0.73) IDO1MAPTHPGDALOX15RECQL
SCHEMBL29351230 0.86 IDO1 (0.73) IDO1MAPTHPGDALOX15RECQL
SCHEMBL442916 0.84 IDO1 (0.81) IDO1MAPTHPGDALOX15RECQL
SCHEMBL13265824 0.84 IDO1 (0.81) IDO1MAPTHPGDALOX15RECQL
SCHEMBL28427946 0.83 IDO1 (0.69) IDO1MAPTHPGDALOX15RECQL

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-5134201-A Miscible polyester blends THE DOW CHEMICAL COMPANY (US) 1992-07-28 US disclosed