SCHEMBL8669012

SCHEMBL8669012

C=C(C)C(=O)OCCOc1ccc(C(=O)CC(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
APEX1 P27695 2/20 0.57
TDP1 Q9NUW8 2/20 0.57
LMNA P02545 1/20 0.57
ALOX15 P16050 1/20 0.57
MAPK1 P28482 1/20 0.57
RECQL P46063 1/20 0.57
HSD17B10 Q99714 1/20 0.57
POLB P06746 2/20 0.54
HTT P42858 1/20 0.54
MAPT P10636 4/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
CASP3 P42574 1/20 0.47
SENP7 Q9BQF6 1/20 0.47
NR4A2 P43354 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
EPHX2 P34913 2/20 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
SCHEMBL12618074 0.91 POLB (0.56) ALDH1A1APEX1TDP1LMNAPOLB
SCHEMBL11997926 0.87 POLB (0.52) ALDH1A1APEX1TDP1POLBHTT
SCHEMBL14142193 0.86 APEX1 (0.58) ALDH1A1APEX1TDP1LMNAALOX15
SCHEMBL12376906 0.85 POLB (0.50) ALDH1A1APEX1TDP1LMNAPOLB
SCHEMBL9018658 0.83 TDP1 (0.64) ALDH1A1APEX1TDP1LMNAALOX15
SCHEMBL59813 0.83 POLB (0.56) ALDH1A1APEX1TDP1LMNAPOLB
SCHEMBL2831138 0.83 POLB (0.56) ALDH1A1APEX1TDP1POLBHTT
SCHEMBL14173142 0.83 POLB (0.56) ALDH1A1APEX1TDP1LMNAPOLB
SCHEMBL454606 0.81 POLB (0.67) ALDH1A1APEX1TDP1LMNAPOLB
SCHEMBL13923791 0.80 TDP1 (0.60) ALDH1A1APEX1TDP1LMNAALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10081716-A None JP disclosed
JP-9169699-A None JP disclosed
JP-H1081716-A ULTRAVIOLET RAY ABSORBING AGENT OSAKA ORGANIC CHEM IND LTD 1998-03-31 JP disclosed
JP-H09169699-A NEW DIBENZOYLMETHANE DERIVATIVE AND ITS PRODUCTION OSAKA ORGANIC CHEM IND LTD 1997-06-30 JP disclosed