SCHEMBL9329639

SCHEMBL9329639

COc1ccccc1COC(=O)c1ccc(C(C)OC(C)=O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 7/20 0.43
ALDH1A1 P00352 7/20 0.43
MAPT P10636 5/20 0.43
MEN1 O00255 4/20 0.43
TSHR P16473 2/20 0.43
HTT P42858 2/20 0.43
HPGD P15428 2/20 0.42
KDM4E B2RXH2 1/20 0.42
HSD17B10 Q99714 1/20 0.42
RAB9A P51151 2/20 0.42
PKM P14618 2/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
GAA P10253 1/20 0.41
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
ADRB3 P13945 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPK1 P28482 1/20 0.39
MTNR1A P48039 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
SCHEMBL9329214 0.89 KMT2A (0.46) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL9328616 0.85 MAOB (0.46) KMT2AALDH1A1MAPTTSHRKDM4E
SCHEMBL9328542 0.85 KMT2A (0.46) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL9330680 0.82 ALDH1A1 (0.55) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL9329611 0.81 KMT2A (0.59) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL9271624 0.80 LMNA (0.57) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL6667180 0.80 PPARG (0.58) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL9330530 0.78 NPC1 (0.50) KMT2AALDH1A1MAPTMEN1TSHR
SCHEMBL9329587 0.78 KMT2A (0.55) KMT2AALDH1A1MAPTMEN1HPGD
SCHEMBL1030014 0.75 IDO1 (0.56) KMT2AALDH1A1MAPTMEN1HTT

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