SCHEMBL7746320

SCHEMBL7746320

O=C(OC(=O)c1ccco1)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.59
PKM P14618 1/20 0.59
KMT2A Q03164 9/20 0.53
ALDH1A1 P00352 7/20 0.50
HSD17B10 Q99714 3/20 0.50
CES2 O00748 1/20 0.50
CES1 P23141 1/20 0.50
PTPN1 P18031 1/20 0.50
TSHR P16473 1/20 0.50
HPGD P15428 1/20 0.49
PTGS1 P23219 1/20 0.49
TDP1 Q9NUW8 2/20 0.48
MEN1 O00255 1/20 0.48
POLB P06746 1/20 0.48
THRB P10828 1/20 0.48
APEX1 P27695 1/20 0.48
RECQL P46063 1/20 0.48
PLA2G7 Q13093 1/20 0.47
RAB9A P51151 1/20 0.47
SLC6A2 P23975 1/20 0.47

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
SCHEMBL896787 0.88 CES2 (0.62) SMN1; SMN2PKMKMT2AALDH1A1HSD17B10
SCHEMBL18050329 0.87 SMN1; SMN2 (0.58) SMN1; SMN2PKMKMT2AALDH1A1HSD17B10
SCHEMBL18050331 0.87 SMN1; SMN2 (0.58) SMN1; SMN2PKMKMT2AALDH1A1HSD17B10
SCHEMBL9364011 0.83 SMN1; SMN2 (0.54) SMN1; SMN2PKMKMT2AALDH1A1HSD17B10
SCHEMBL28432314 0.82 KMT2A (0.64) SMN1; SMN2KMT2AALDH1A1HPGDTDP1
SCHEMBL28297982 0.81 KMT2A (0.55) PKMKMT2AALDH1A1HSD17B10CES2
SCHEMBL11697583 0.81 ALDH1A1 (0.54) SMN1; SMN2PKMKMT2AALDH1A1HSD17B10
SCHEMBL28278771 0.80 KMT2A (0.58) SMN1; SMN2PKMKMT2AALDH1A1HSD17B10
SCHEMBL52413 0.79 LMNA (0.70) SMN1; SMN2KMT2AALDH1A1HSD17B10CES2
Hydrogen Peroxide SCHEMBL27952375 0.79 LMNA (0.70) SMN1; SMN2KMT2AALDH1A1HSD17B10CES2

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
WO-2001028960-A1 A RECOMBINANT URUSHI LACQUER AND A PROCESS FOR PREPARING THE SAME KIM WOO SHIK (KR) 2001-04-26 WO disclosed