SCHEMBL9797335

SCHEMBL9797335

[O]C(C(=O)O)c1ccc(Cl)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 4/20 0.47
CYP2C19 P33261 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
CYP2D6 P10635 2/20 0.47
HSD17B10 Q99714 2/20 0.47
BRD4 O60885 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
TSHR P16473 2/20 0.46
ALOX15 P16050 1/20 0.46
GABBR2 O75899 3/20 0.46
GABBR1 Q9UBS5 3/20 0.46
LMNA P02545 2/20 0.46
CYP3A4 P08684 1/20 0.46
ADORA3 P0DMS8 1/20 0.46
NFKB1 P19838 1/20 0.46
DRD3 P35462 1/20 0.46
BLM P54132 1/20 0.46

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
SCHEMBL75753 0.79 CES2 (0.52) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL9298853 0.79 CES2 (0.52) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL467546 0.78 HDAC4 (0.59) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL5220963 0.78 SRC (0.61) CYP2C9CYP2C19KMT2AMEN1CYP2D6
Hydrochloric Acid SCHEMBL75859 0.77 CES2 (0.50) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL182527 0.77 SRC (0.59) CYP2C19KMT2ACYP2D6HDAC4HDAC7
SCHEMBL6366 0.76 LMNA (0.62) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL6367 0.76 LMNA (0.62) CYP2C9CYP2C19KMT2AMEN1CYP2D6
Hydrochloric Acid SCHEMBL933980 0.76 HDAC4 (0.57) CYP2C9CYP2C19KMT2AMEN1CYP2D6
SCHEMBL2454097 0.76 CYP2C9 (0.47) CYP2C9CYP2C19KMT2AMEN1CYP2D6

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
US-5059542-A Crosslinked complex of anionic polymer and synthetic polyamino acid JURIDICAL FOUNDATION THE CHEMO-SERO-THERAPEUTIC RESEARCH INSTITUTE (JP) 1991-10-22 US disclosed