Catechol

Catechol

SCHEMBL27477807

NC(=O)NC=O.Oc1ccccc1O

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.45
MAPT P10636 4/20 0.45
ALDH1A1 P00352 3/20 0.45
HPGD P15428 3/20 0.45
HSD17B10 Q99714 2/20 0.45
TSHR P16473 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.43
HIF1A Q16665 2/20 0.43
CA12 O43570 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
CA14 Q9ULX7 2/20 0.43
LMNA P02545 2/20 0.43
NFKB1 P19838 2/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
EGFR P00533 1/20 0.43
FYN P06241 1/20 0.43
POLB P06746 1/20 0.43
CA3 P07451 1/20 0.43

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
Orthocresol SCHEMBL27537728 0.87 ALDH1A1 (0.42) KDM4EMAPTALDH1A1HPGDHSD17B10
Biphenyl SCHEMBL28340467 0.83 LMNA (0.42) KDM4EMAPTALDH1A1HSD17B10TSHR
Benzene SCHEMBL27335460 0.81 TSHR (0.35) MAPTALDH1A1HSD17B10TSHRCA2
Resorcinol SCHEMBL27314174 0.79 PARP1 (0.48) KDM4EALDH1A1HSD17B10CA12CA2
Resorcinol SCHEMBL28241681 0.79 PARP1 (0.48) KDM4EALDH1A1HSD17B10CA12CA2
SCHEMBL20457 0.78
SCHEMBL28045225 0.77 MAPT (0.43) KDM4EMAPTALDH1A1HSD17B10TSHR
Catechol SCHEMBL27312859 0.77 KDM4E (0.53) KDM4EMAPTALDH1A1HPGDHSD17B10
Hydrochloric Acid SCHEMBL28914936 0.75
SCHEMBL28411184 0.75

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
CN-1142552-A Paper machine pressing fabrics ALBANCY INTERNATIONAL CORP (US) 1997-02-12 CN disclosed