Catechol

Catechol

SCHEMBL8935190

Oc1cccc2cccc(O)c12.Oc1ccccc1O

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.59
HSD17B10 Q99714 7/20 0.59
HPGD P15428 6/20 0.59
MAPT P10636 6/20 0.59
ALOX15 P16050 4/20 0.59
RECQL P46063 3/20 0.59
TDP1 Q9NUW8 3/20 0.59
L3MBTL1 Q9Y468 3/20 0.59
LMNA P02545 3/20 0.59
RAB9A P51151 3/20 0.59
KDM4E B2RXH2 3/20 0.59
CYP3A4 P08684 2/20 0.59
EGFR P00533 2/20 0.59
CA2 P00918 2/20 0.59
FYN P06241 2/20 0.59
MMP9 P14780 2/20 0.59
NPC1 O15118 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.59
POLB P06746 2/20 0.59
CA12 O43570 1/20 0.59

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
SCHEMBL29363189 0.94 ALDH1A1 (0.62) ALDH1A1HSD17B10HPGDMAPTALOX15
SCHEMBL70219 0.94 ALDH1A1 (0.62) ALDH1A1HSD17B10HPGDMAPTALOX15
SCHEMBL9115296 0.91 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDMAPTALOX15
Pyrene SCHEMBL27795191 0.88 ALDH1A1 (0.65) ALDH1A1HSD17B10HPGDMAPTALOX15
SCHEMBL7126508 0.85 ALDH1A1 (0.59) ALDH1A1HSD17B10HPGDMAPTALOX15
Bicarbonate SCHEMBL11662741 0.83 KMT2A (0.52) ALDH1A1HSD17B10HPGDMAPTALOX15
Catechol SCHEMBL29115865 0.83 CYP1A2 (0.64) ALDH1A1HSD17B10HPGDMAPTALOX15
Naphthalene SCHEMBL28157373 0.81 ALDH1A1 (0.77) ALDH1A1HSD17B10HPGDMAPTALOX15
SCHEMBL4660302 0.80 ALDH1A1 (0.57) ALDH1A1HSD17B10HPGDMAPTALOX15
SCHEMBL1520933 0.79 DBH (0.54) ALDH1A1HSD17B10HPGDMAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5538752-A APPLYING PRESERVATIVES TO PLANTS TO INHIBIT DECAY REGENTS OF THE UNIV. OF MINNESOTA (US) 1996-07-23 US disclosed
EP-0580734-A1 MELANIN-BASED AGENTS FOR IMAGE ENHANCEMENT BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1994-02-02 EP disclosed
WO-1992018166-A1 MELANIN-BASED AGENTS FOR IMAGE ENHANCEMENT BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1992-10-29 WO disclosed