SCHEMBL28051316

SCHEMBL28051316

C=C(C)c1cc(C(=O)O)ccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
CDC25A P30304 1/20 0.48
CDC25B P30305 1/20 0.48
HSD17B10 Q99714 1/20 0.48
MYC P01106 1/20 0.47
TDP1 Q9NUW8 2/20 0.47
POLB P06746 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
ACE2 Q9BYF1 2/20 0.45
RAB9A P51151 2/20 0.44
LMNA P02545 1/20 0.44
AKR1C3 P42330 4/20 0.44
AKR1C2 P52895 4/20 0.44
SORT1 Q99523 1/20 0.43
TSHR P16473 3/20 0.43
GAA P10253 2/20 0.43
ALDH1A1 P00352 2/20 0.43
AKR1B10 O60218 1/20 0.43
AKR1B1 P15121 1/20 0.43
AKR1C4 P17516 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
Methacrylic Acid SCHEMBL2873454 0.86 KDM4E (0.55) KDM4ECDC25ACDC25BHSD17B10MYC
Acetic Acid SCHEMBL28378441 0.85 KDM4E (0.62) KDM4ECDC25ACDC25BHSD17B10MYC
Acetic Acid SCHEMBL39490 0.85 KDM4E (0.62) KDM4ECDC25ACDC25BHSD17B10MYC
Acetic Acid SCHEMBL28658551 0.85 KDM4E (0.62) KDM4ECDC25ACDC25BHSD17B10MYC
Acetic Acid SCHEMBL28378940 0.85 KDM4E (0.62) KDM4ECDC25ACDC25BHSD17B10MYC
Acetic Acid SCHEMBL17891250 0.83 KDM4E (0.60) KDM4ECDC25ACDC25BHSD17B10MYC
SCHEMBL15507330 0.83 KDM4E (0.60) KDM4ECDC25ACDC25BHSD17B10MYC
Ethylene SCHEMBL7933201 0.83 KDM4E (0.64) KDM4ECDC25ACDC25BHSD17B10MYC
Ethylene SCHEMBL11178408 0.83 KDM4E (0.64) KDM4ECDC25ACDC25BHSD17B10MYC
Methyl Alcohol SCHEMBL29156163 0.83 KDM4E (0.64) KDM4ECDC25ACDC25BHSD17B10MYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104114602-B Non-crystalline state, high glass-transition temperature copolyester composition, its preparation method and goods SAUDI BASIC INDUSTRIES CORP. (SA) 2016-02-10 CN disclosed