SCHEMBL7048447

SCHEMBL7048447

CCOC(=O)C(CC(=O)O)=C1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.41
GRIK1 P39086 3/20 0.40
ALDH1A1 P00352 7/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CYP2D6 P10635 2/20 0.39
GRIA1 P42261 1/20 0.38
GRIA2 P42262 1/20 0.38
GRIA4 P48058 1/20 0.38
GRIK3 Q13003 1/20 0.38
GRIK5 Q16478 1/20 0.38
HPGD P15428 3/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
GAA P10253 4/20 0.34
MAPT P10636 4/20 0.33
LMNA P02545 2/20 0.33
HTT P42858 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 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
SCHEMBL4661676 0.85 MGAM (0.45) GRIK1ALDH1A1SMN1; SMN2CYP2D6HPGD
SCHEMBL6555623 0.84 GRIK1 (0.43) EGLN1GRIK1ALDH1A1GRIA1GRIA2
SCHEMBL13060426 0.82 GRIK1 (0.42) EGLN1GRIK1GRIA1GRIA2GRIA4
SCHEMBL27789732 0.81 GRIK1 (0.38) GRIK1ALDH1A1SMN1; SMN2GRIA1GRIA2
SCHEMBL14277683 0.78 GRIK1 (0.42) EGLN1GRIK1GRIA1GRIA2GRIA4
SCHEMBL28052037 0.78 FAAH (0.37) GRIK1ALDH1A1GRIA1GRIA2GRIA4
SCHEMBL13269286 0.76 ALDH1A1 (0.39) EGLN1ALDH1A1SMN1; SMN2HPGDKDM4E
SCHEMBL3179017 0.76 MAPT (0.38) EGLN1GRIK1ALDH1A1HPGDKDM4E
SCHEMBL28661006 0.75 GRIK1 (0.53) GRIK1ALDH1A1SMN1; SMN2GRIA1GRIA2
SCHEMBL6356446 0.75 GRIK1 (0.39) EGLN1GRIK1ALDH1A1SMN1; SMN2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1042270-B1 ASYMMETRIC HYDROGENATION CHIROTECH TECHNOLOGY LTD (GB) 2003-04-09 EP disclosed
US-6207853-B1 SUCCINIC ACID DERIVATIVE CHIROTECH TECHNOLOGY, INC. (GB) 2001-03-27 US disclosed
EP-1042270-A1 ASYMMETRIC HYDROGENATION Chirotech Technology Limited (GB) 2000-10-11 EP disclosed
WO-1999031041-A1 ASYMMETRIC HYDROGENATION CHIROTECH TECHNOLOGY LIMITED (GB) 1999-06-24 WO disclosed