SCHEMBL9047619

SCHEMBL9047619

Cc1ccccc1C=C1CC(=O)OC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
ALDH1A1 P00352 3/20 0.47
RAB9A P51151 2/20 0.47
MAPT P10636 2/20 0.47
NPC1 O15118 1/20 0.47
TP53 P04637 1/20 0.47
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ACHE P22303 1/20 0.44
TTR P02766 1/20 0.44
TSHR P16473 1/20 0.42
NAT1 P18440 1/20 0.42
CYP26A1 O43174 1/20 0.42
HDAC1 Q13547 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 2/20 0.36

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
SCHEMBL9047611 1.00 KDM4E (0.51) KDM4ECYP1A2CYP2C19ALDH1A1RAB9A
SCHEMBL9046784 0.81 KDM4E (0.34) KDM4ECYP1A2CYP2C19ALDH1A1MAPT
SCHEMBL9046794 0.81 KDM4E (0.34) KDM4ECYP1A2CYP2C19ALDH1A1MAPT
SCHEMBL9047786 0.79 DYRK2 (0.56) ALDH1A1MAPTACHEHDAC1
SCHEMBL9047790 0.79 DYRK2 (0.56) ALDH1A1MAPTACHEHDAC1
SCHEMBL9046118 0.79 IKBKB (0.58) ALDH1A1RAB9AMAPTNPC1ACHE
SCHEMBL9046126 0.79 IKBKB (0.58) ALDH1A1RAB9AMAPTNPC1ACHE
SCHEMBL9050279 0.79 KDM4E (0.57) KDM4EALDH1A1MAPTNPC1ACHE
SCHEMBL9047693 0.79 IKBKB (0.33) KDM4ECYP1A2CYP2C19ALDH1A1MAPT
SCHEMBL9047712 0.79 IKBKB (0.33) KDM4ECYP1A2CYP2C19ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed