SCHEMBL9427353

SCHEMBL9427353

Oc1ccccc1OC(O)O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.52
TP53 P04637 2/20 0.52
TSHR P16473 2/20 0.52
CA1 P00915 1/20 0.52
MAPT P10636 4/20 0.48
LMNA P02545 3/20 0.48
GAA P10253 3/20 0.48
JAK2 O60674 1/20 0.48
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 4/20 0.43
ALOX15 P16050 3/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 3/20 0.43
CYP3A4 P08684 2/20 0.43
POLB P06746 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
CA12 O43570 1/20 0.43
GMNN O75496 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
SCHEMBL2352949 0.81 CA2 (0.54) CA2TP53TSHRCA1MAPT
SCHEMBL363528 0.78 CA2 (0.50) CA2TP53TSHRCA1MAPT
SCHEMBL10417879 0.78 CA2 (0.50) CA2TP53TSHRCA1MAPT
SCHEMBL104203 0.78 TP53 (0.56) CA2TP53TSHRCA1MAPT
SCHEMBL10842648 0.78 CA2 (0.50) CA2TP53TSHRCA1MAPT
SCHEMBL8747528 0.78 CA2 (0.56) CA2TP53TSHRCA1MAPT
SCHEMBL29737595 0.78 TP53 (0.56) CA2TP53TSHRCA1MAPT
SCHEMBL2349413 0.76 TSHR (0.48) CA2TP53TSHRCA1MAPT
SCHEMBL10748540 0.75 LMNA (0.48) CA2TP53TSHRCA1MAPT
SCHEMBL7559302 0.75 TSHR (0.52) CA2TP53TSHRCA1MAPT

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-9164409-B2 Biophenols for polyester toner resins XEROX CORPORATION (US) 2015-10-20 US disclosed
US-20140322642-A1 Biophenols for Polyester Toner Resins XEROX CORPORATION (US) 2014-10-30 US disclosed
US-5350865-A Fluorination of dichlorobenzodioxole with hydrogen fluoride BAYER AKTIENGESELLSCHAFT (DE) 1994-09-27 US disclosed