SCHEMBL8964176

SCHEMBL8964176

Oc1cccc(O)c1C(O)(O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.47
ALOX15 P16050 5/20 0.47
TDP1 Q9NUW8 4/20 0.47
HPGD P15428 4/20 0.47
HSD17B10 Q99714 4/20 0.47
CA2 P00918 3/20 0.47
RECQL P46063 3/20 0.47
LMNA P02545 3/20 0.47
EGFR P00533 2/20 0.47
FYN P06241 2/20 0.47
MMP9 P14780 2/20 0.47
CA1 P00915 2/20 0.47
ADAMTS4 O75173 1/20 0.47
MMP2 P08253 1/20 0.47
MMP8 P22894 1/20 0.47
CA6 P23280 1/20 0.47
CDK2 P24941 1/20 0.47
MMP12 P39900 1/20 0.47
ADAMTS5 Q9UNA0 1/20 0.47
MAPT P10636 3/20 0.44

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
SCHEMBL18545944 0.77 TRPA1 (0.46) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL22839343 0.77 ALDH1A1 (0.43) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL2729698 0.77 TRPA1 (0.46) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL419708 0.73 ALDH1A1 (0.52) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL5512574 0.73 TDP1 (0.45) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL7708165 0.71 TRPA1 (0.41) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL7559720 0.69 ALDH1A1 (0.55) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL28917261 0.69 BACE1 (0.41) ALDH1A1TDP1HPGDHSD17B10CA1
SCHEMBL2059960 0.67 ALDH1A1 (0.59) ALDH1A1ALOX15TDP1HPGDHSD17B10
SCHEMBL6473329 0.66 TRPA1 (0.58) ALDH1A1ALOX15TDP1HPGDHSD17B10

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-5543487-A PRIMER FOR THERMOSETTING ADHESIVES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 1996-08-06 US disclosed