SCHEMBL8949871

SCHEMBL8949871

O=C(c1ccccc1)c1c(CO)cc(CO)cc1CO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ATM Q13315 1/20 0.47
PTGS2 P35354 2/20 0.47
PTGS1 P23219 1/20 0.47
CNR2 P34972 1/20 0.46
TSHR P16473 2/20 0.43
SRD5A2 P31213 1/20 0.42
KDM4E B2RXH2 2/20 0.41
CASP6 P55212 1/20 0.41
PBRM1 Q86U86 1/20 0.40
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
MAPK1 P28482 2/20 0.40
GAA P10253 2/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
AKR1C3 P42330 1/20 0.39
ELANE P08246 1/20 0.39

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
SCHEMBL2859233 0.80 CNR2 (0.47) ALDH1A1TDP1L3MBTL1ATMCNR2
SCHEMBL27934039 0.79 CHRNB2 (0.48) ALDH1A1L3MBTL1CNR2TSHRMEN1
Benzophenone SCHEMBL27760924 0.77 ALDH1A1 (0.67) ALDH1A1TDP1L3MBTL1ATMPTGS2
SCHEMBL10350347 0.77 PTGS2 (0.54) ALDH1A1TDP1L3MBTL1ATMPTGS2
SCHEMBL2861850 0.77 CNR2 (0.47) ALDH1A1TDP1L3MBTL1ATMPTGS2
SCHEMBL2641948 0.75 ALDH1A1 (0.64) ALDH1A1TDP1L3MBTL1ATMCNR2
SCHEMBL653244 0.75 HPGD (0.38) ALDH1A1L3MBTL1TSHRKDM4ECASP6
SCHEMBL7046114 0.74 L3MBTL1 (0.65) ALDH1A1TDP1L3MBTL1ATMPTGS2
SCHEMBL26998263 0.73 ATM (0.57) ALDH1A1TDP1L3MBTL1ATMPTGS2
SCHEMBL29898649 0.72 AKR1C3 (0.57) ALDH1A1TDP1L3MBTL1ATMTSHR

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0719425-A1 PHOTOSENSITIVE COMPOSITIONS AND ELEMENTS FOR FLEXOGRAPHIC PRINTING CHASE ELASTOMER CORPORATION (US) 1996-07-03 EP disclosed
US-5496685-A MANUFACTURING A PRINTING PLATE CHASE ELASTOMER CORPORATION (US) 1996-03-05 US disclosed
US-5496684-A IMAGE WISE EXPOSURE TO ACTINIC RADIATION FOR LIGHT SENSITIVE ELEMENT SUPPORTS, REMOVAL OF LAYER WITH SOLVENT FOR PLATES AND DEVELOPMENT OF CROSSLINKING AGENT CHASE ELASTOMER CORPORATION (US) 1996-03-05 US disclosed
WO-1995008137-A1 PHOTOSENSITIVE COMPOSITIONS AND ELEMENTS FOR FLEXOGRAPHIC PRINTING CHASE ELASTOMER CORPORATION (US) 1995-03-23 WO disclosed
WO-1995008136-A1 PHOTOSENSITIVE COMPOSITIONS AND ELEMENTS FOR FLEXOGRAPHIC PRINTING CHASE ELASTOMER CORPORATION (US) 1995-03-23 WO disclosed