SCHEMBL7644872

SCHEMBL7644872

CCOC(=O)C(CCCCC(C)C)=NO

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APOBEC3A P31941 1/20 0.55
APOBEC3G Q9HC16 1/20 0.55
KDM4C Q9H3R0 2/20 0.37
KDM4A O75164 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
KDM2A Q9Y2K7 1/20 0.37
KYAT1 Q16773 6/20 0.36
FAAH O00519 2/20 0.34
KMT2A Q03164 2/20 0.33
PTPN1 P18031 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL7634101 0.98 APOBEC3A (0.54) APOBEC3AAPOBEC3GKDM4CKDM4APHF8
SCHEMBL7634890 0.95 APOBEC3A (0.56) APOBEC3AAPOBEC3GKDM4CKDM4APHF8
SCHEMBL7634040 0.88 APOBEC3A (0.51) APOBEC3AAPOBEC3GKYAT1MAPT
SCHEMBL7643891 0.83 KDM4C (0.39) APOBEC3AAPOBEC3GKDM4CKDM4APHF8
SCHEMBL7640240 0.82 APOBEC3A (0.61) APOBEC3AAPOBEC3GKYAT1FAAHKMT2A
SCHEMBL7641298 0.81 KDM4C (0.41) APOBEC3AAPOBEC3GKDM4CKDM4APHF8
SCHEMBL7637349 0.81 LMNA (0.37) APOBEC3AAPOBEC3GKDM4CKDM4APHF8
SCHEMBL7639888 0.81 APOBEC3A (0.59) APOBEC3AAPOBEC3GFAAHKMT2APTPN1
SCHEMBL7635778 0.81 APOBEC3A (0.59) APOBEC3AAPOBEC3GFAAHKMT2APTPN1
SCHEMBL7643168 0.81 APOBEC3A (0.59) APOBEC3AAPOBEC3GFAAHKMT2APTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6348617-B1 REACTING PYRUVIC ACID COMPOUND IN WATER WITH AMMONIUM OR ALKALI METAL BISULFITE TO GIVE AQUEOUS SOLUTION OF BISULFITE ADDUCT, ISOLATING BY PHASE SEPARATION, OPTIONALLY USING HYDROPHOBIC SOLVENT, CONTACTING WITH ACID TO DECOMPOSE ADDUCT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2002-02-19 US disclosed
EP-0937703-A1 METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1999-08-25 EP disclosed