SCHEMBL8979698

SCHEMBL8979698

C=C(CC(=O)OCc1ccc(Br)cc1)C(=O)OCc1ccc(Br)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
KMT2A Q03164 4/20 0.46
ALDH1A1 P00352 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MEN1 O00255 2/20 0.46
HPGD P15428 2/20 0.46
TP53 P04637 1/20 0.46
KDM4E B2RXH2 3/20 0.45
MMP1 P03956 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
FABP7 O15540 1/20 0.40
FABP5 Q01469 1/20 0.40
POLB P06746 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
RXRA P19793 1/20 0.40
RXRB P28702 1/20 0.40
IDO1 P14902 1/20 0.39
MAOB P27338 1/20 0.39
MAPK1 P28482 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
SCHEMBL19020082 0.84 MAPT (0.55) MAPTKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9355172 0.84 MEN1 (0.49) MAPTKMT2AALDH1A1MEN1KDM4E
SCHEMBL1045139 0.83 ALDH1A1 (0.58) KMT2AALDH1A1SMN1; SMN2MEN1L3MBTL1
SCHEMBL9358992 0.82 GLA (0.55) KMT2AALDH1A1SMN1; SMN2MMP1IDO1
SCHEMBL6430060 0.81 ALDH1A1 (0.55) MAPTKMT2AALDH1A1SMN1; SMN2MMP1
SCHEMBL10661072 0.80 MMP12 (0.45) KMT2AMEN1MMP1IDO1MAOB
SCHEMBL27957862 0.80 KMT2A (0.54) MAPTKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL9355221 0.79 ALDH1A1 (0.45) MAPTKMT2AALDH1A1SMN1; SMN2MEN1
SCHEMBL1764063 0.78 ALDH1A1 (0.51) MAPTKMT2AALDH1A1SMN1; SMN2MEN1
Butane SCHEMBL14935067 0.78 POLB (0.54) MAPTKMT2AALDH1A1SMN1; SMN2MEN1

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
US-5340893-A Blend containing an allyl containing polyester NOF CORPORATION (JP) 1994-08-23 US claimed
EP-0540043-B1 Cast resin for optical use NOF CORP (JP) 1996-05-15 EP disclosed
US-5340893-A Blend containing an allyl containing polyester NOF CORPORATION (JP) 1994-08-23 US disclosed
EP-0540043-A1 Cast resin for optical use NOF CORPORATION (JP) 1993-05-05 EP disclosed