SCHEMBL8948482

SCHEMBL8948482

O=CCC[C@@H](O)[C@H](O)CO

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.38
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
TDP1 Q9NUW8 1/20 0.35
HIF1A Q16665 1/20 0.32
MPI P34949 1/20 0.31
PDE4A P27815 1/20 0.31

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
SCHEMBL423446 1.00 AKR1B1 (0.38) AKR1B1LMNAL3MBTL1TDP1HIF1A
SCHEMBL423445 1.00 AKR1B1 (0.38) AKR1B1LMNAL3MBTL1TDP1HIF1A
SCHEMBL504375 1.00 AKR1B1 (0.38) AKR1B1LMNAL3MBTL1TDP1HIF1A
SCHEMBL8653995 1.00 AKR1B1 (0.38) AKR1B1LMNAL3MBTL1TDP1HIF1A
Hydrochloric Acid SCHEMBL15779291 0.97 AKR1B1 (0.36) AKR1B1LMNAL3MBTL1TDP1HIF1A
Phosphoric Acid SCHEMBL5789491 0.91 MPI (0.39) AKR1B1LMNAL3MBTL1MPI
SCHEMBL5699947 0.85 AKR1B1 (0.43) AKR1B1
SCHEMBL17984936 0.85 HIF1A (0.41) AKR1B1LMNAL3MBTL1TDP1HIF1A
SCHEMBL17984952 0.85 LMNA (0.46) AKR1B1LMNAL3MBTL1TDP1PDE4A
SCHEMBL17984927 0.84 THRB (0.33) AKR1B1HIF1AMPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5510470-A CONTAINS A DIDEOXYSACCHARIDE; USED WITH ZERO VALENT NICKEL AS A CATALYST FOR ENANTIOSELECTIVE HYDROCYANATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 US claimed
US-5484902-A HYDROCYANATION OF VINYL AROMATICS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-01-16 US claimed
US-5510470-A CONTAINS A DIDEOXYSACCHARIDE; USED WITH ZERO VALENT NICKEL AS A CATALYST FOR ENANTIOSELECTIVE HYDROCYANATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 US disclosed