SCHEMBL7643891

SCHEMBL7643891

COC(=O)C(CCCCC(C)C)=NO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 2/20 0.39
KDM4A O75164 1/20 0.39
PHF8 Q9UPP1 1/20 0.39
KDM2A Q9Y2K7 1/20 0.39
APOBEC3A P31941 1/20 0.36
APOBEC3G Q9HC16 1/20 0.36
BLM P54132 2/20 0.35
TSHR P16473 2/20 0.35
MEN1 O00255 1/20 0.35
CYP1A2 P05177 1/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
PMP22 Q01453 1/20 0.35
KMT2A Q03164 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
DEGS1 O15121 1/20 0.33

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
SCHEMBL7641298 0.98 KDM4C (0.41) KDM4CKDM4APHF8KDM2AAPOBEC3A
SCHEMBL7634077 0.95 APOBEC3A (0.37) KDM4CKDM4APHF8KDM2AAPOBEC3A
SCHEMBL7634816 0.87 CA1 (0.40) APOBEC3AAPOBEC3GTSHRCA1
SCHEMBL7637349 0.84 LMNA (0.37) KDM4CKDM4APHF8KDM2AAPOBEC3A
SCHEMBL7644872 0.83 APOBEC3A (0.55) KDM4CKDM4APHF8KDM2AAPOBEC3A
SCHEMBL7643114 0.83 LMNA (0.40) KDM4CKDM4APHF8KDM2AAPOBEC3A
SCHEMBL7634101 0.81 APOBEC3A (0.54) KDM4CKDM4APHF8KDM2AAPOBEC3A
SCHEMBL7637006 0.79 CES2 (0.43) APOBEC3AAPOBEC3GTSHRMEN1POLB
SCHEMBL7642991 0.79 APOBEC3A (0.36) APOBEC3AAPOBEC3GBLMTSHRCA1
SCHEMBL7641893 0.78 CES2 (0.45) TSHRMEN1POLBKMT2APTPN1

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