Catechol

Catechol

SCHEMBL28181592

CC(C)(C)c1c(O)ccc(O)c1C(C)(C)C.Oc1ccccc1O

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.54
TDP1 Q9NUW8 3/20 0.54
TSHR P16473 3/20 0.54
ALOX15 P16050 5/20 0.53
HSD17B10 Q99714 4/20 0.53
HPGD P15428 3/20 0.53
CA2 P00918 3/20 0.53
MAPT P10636 3/20 0.53
LMNA P02545 2/20 0.53
RECQL P46063 2/20 0.53
KDM4E B2RXH2 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPC1 O15118 1/20 0.53
CA12 O43570 1/20 0.53
GMNN O75496 1/20 0.53
EGFR P00533 1/20 0.53
FYN P06241 1/20 0.53
POLB P06746 1/20 0.53
CA3 P07451 1/20 0.53
CYP3A4 P08684 1/20 0.53

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
SCHEMBL30027143 0.89 ALDH1A1 (0.48) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL70068 0.89 ALDH1A1 (0.48) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL419708 0.83 ALDH1A1 (0.52) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL5694506 0.81 ALDH1A1 (0.42) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL30105383 0.80 BACE1 (0.48) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL30048420 0.77 ALDH1A1 (0.48) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL29359879 0.77 ESR1 (0.43) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL36472 0.77 ESR1 (0.43) ALDH1A1TDP1TSHRALOX15HSD17B10
SCHEMBL142313 0.77 ALDH1A1 (0.48) ALDH1A1TDP1TSHRALOX15HSD17B10
Pyrogallol SCHEMBL6035335 0.77 TRPA1 (0.48) ALDH1A1TDP1TSHRALOX15HSD17B10

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-107532129-A Efficient small volume nucleic acid synthesis 生命技术公司 2018-01-02 CN disclosed