SCHEMBL9329587

SCHEMBL9329587

CC(=O)OC(C)c1ccc(-c2ccc(C(=O)OCc3ccccc3)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.55
TDP1 Q9NUW8 3/20 0.55
SLC6A2 P23975 1/20 0.55
SLC6A3 Q01959 1/20 0.55
LMNA P02545 5/20 0.55
MAPT P10636 5/20 0.52
ALDH1A1 P00352 3/20 0.52
HPGD P15428 1/20 0.52
RAB9A P51151 6/20 0.48
GAA P10253 2/20 0.48
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 1/20 0.48
NPC1 O15118 3/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MMP12 P39900 1/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.44
SLC1A5 Q15758 1/20 0.43
ACACB O00763 1/20 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
SCHEMBL9329611 0.96 KMT2A (0.59) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9331015 0.88 KMT2A (0.55) KMT2ALMNAMAPTALDH1A1HPGD
SCHEMBL9329526 0.84 KMT2A (0.61) KMT2ATDP1SLC6A2SLC6A3LMNA
Benzyl Benzoate SCHEMBL3824242 0.82 KMT2A (0.68) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9329080 0.82 CA12 (0.50) KMT2ATDP1LMNAMAPTALDH1A1
SCHEMBL9330530 0.82 NPC1 (0.50) KMT2AMAPTALDH1A1HPGDRAB9A
SCHEMBL9537786 0.82 KMT2A (0.81) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL9125577 0.82 ACACB (0.62) LMNAL3MBTL1ACACB
SCHEMBL9331636 0.81 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA
SCHEMBL15614364 0.81 KMT2A (0.69) KMT2ATDP1SLC6A2SLC6A3LMNA

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-5332675-A Liquid crystals SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-07-26 US disclosed
EP-0289307-B1 OPTICALLY ACTIVE AROMATIC CARBOXYLIC ACID DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-08 EP disclosed
US-5019298-A Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-05-28 US disclosed
EP-0289307-A2 Optically active aromatic carboxylic acid derivatives and process for producing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-11-02 EP disclosed