Catechol

Catechol

SCHEMBL4370165

CCC(=COC=C(CC)CC)CC.Oc1ccccc1O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.43
LMNA P02545 3/20 0.43
CA12 O43570 2/20 0.43
CA14 Q9ULX7 2/20 0.43
MAPT P10636 2/20 0.43
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
GMNN O75496 1/20 0.43
ALDH1A1 P00352 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
CYP3A4 P08684 1/20 0.43
MMP9 P14780 1/20 0.43
HPGD P15428 1/20 0.43
ALOX15 P16050 1/20 0.43
NFKB1 P19838 1/20 0.43
CA4 P22748 1/20 0.43
APEX1 P27695 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
Catechol SCHEMBL4376198 0.85 IAPP (0.39) CA2LMNACA12CA14MAPT
Hydroquinone SCHEMBL4368343 0.82 ESR1 (0.44) CA2LMNACA12CA14MAPT
Resorcinol SCHEMBL4365833 0.79 ALDH1A1 (0.48) CA2LMNACA12CA14ALDH1A1
SCHEMBL540179 0.78
Catechol SCHEMBL4370641 0.75 LMNA (0.50) CA2LMNACA12CA14MAPT
Catechol SCHEMBL11566875 0.72 CA2 (0.71) CA2LMNACA12CA14MAPT
Catechol SCHEMBL7569845 0.72 CA2 (0.71) CA2LMNACA12CA14MAPT
Catechol SCHEMBL665292 0.70 ALDH1A1 (0.67) CA2LMNACA12CA14MAPT
Catechol SCHEMBL2581350 0.70 ALDH1A1 (0.67) CA2LMNACA12CA14MAPT
Catechol SCHEMBL10638284 0.69 CA2 (0.56) CA2LMNACA12CA14MAPT

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-20090035696-A1 PHOTORESIST COMPOSITION KYOWA HAKKO CHEMICAL CO., LTD. (JP) 2009-02-05 US disclosed