SCHEMBL10935339

SCHEMBL10935339

CCOC(=O)c1ccc2cc(OCCOc3ccc4cc(C(=O)O)ccc4c3)ccc2c1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
KDM4E B2RXH2 1/20 0.54
HRH3 Q9Y5N1 1/20 0.52
HTT P42858 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
POLB P06746 1/20 0.49
CASP6 P55212 1/20 0.49
PLA2G4B P0C869 1/20 0.49
KMT2A Q03164 1/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA7 P43166 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49

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
SCHEMBL1191191 0.94 TDP1 (0.65) TDP1L3MBTL1CA12CA1CA2
SCHEMBL7642823 0.89 HRH3 (0.61) L3MBTL1KDM4EHRH3KMT2ACA12
SCHEMBL4085075 0.86 CA12 (0.56) TDP1L3MBTL1TP53KMT2ACA12
SCHEMBL465148 0.86 KDM4E (0.65) KDM4EHTTTP53TSHRPLA2G4B
SCHEMBL10824877 0.86 KDM4E (0.50) TDP1L3MBTL1KDM4EHTTTP53
SCHEMBL17549737 0.84 TDP1 (0.54) TDP1L3MBTL1CA12CA1CA2
SCHEMBL10080517 0.83 HTT (0.55) KDM4EHTTTP53TSHRPLA2G4B
SCHEMBL6836190 0.83 TP53 (0.71) KDM4ETP53TSHRPLA2G4B
SCHEMBL868230 0.83 KMT2A (0.69) KDM4ETP53TSHRPLA2G4BKMT2A
SCHEMBL11852325 0.83 TDP1 (0.67) TDP1L3MBTL1HTTTP53TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60215648-A None JP disclosed
JP-S60215648-A 6,6'-(ETHYLENEDIOXY)-DI-2-NAPHTHOIC ACID, ITS DERIVATIVE AND PREPARATION THEREOF TEIJIN LTD 1985-10-29 JP disclosed