SCHEMBL29477335

SCHEMBL29477335

CCCCC(CO)(CO)CC(O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
LMNA P02545 2/20 0.33
CYP2D6 P10635 2/20 0.32
CYP3A4 P08684 2/20 0.32
SPHK1 Q9NYA1 2/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32
KDM4E B2RXH2 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
MAPT P10636 1/20 0.32
CETP P11597 1/20 0.32
HTT P42858 1/20 0.32
UBE2N P61088 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
GPR84 Q9NQS5 3/20 0.30

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
SCHEMBL7776271 0.80 ALDH1A1 (0.37) ALDH1A1LMNACYP2D6CYP3A4SPHK1
SCHEMBL2346689 0.80 ALDH1A1 (0.42) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL227493 0.80 ALDH1A1 (0.42) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL165249 0.80 ALDH1A1 (0.42) ALDH1A1LMNATSHRSMN1; SMN2FDPS
Ammonia Solution, Strong SCHEMBL5707582 0.78 ALDH1A1 (0.40) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL1050069 0.75 ALDH1A1 (0.38) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL2345789 0.75 ALDH1A1 (0.38) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL21161 0.75 ALDH1A1 (0.38) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL2347158 0.75 ALDH1A1 (0.38) ALDH1A1LMNATSHRSMN1; SMN2FDPS
SCHEMBL251421 0.75 ALDH1A1 (0.38) ALDH1A1LMNATSHRSMN1; SMN2FDPS

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-20220089837-A1 MATERIAL FOR HOT MELT EXTRUSION SYSTEM, MODELING MATERIAL FOR 3D PRINTERS, METHOD FOR PRODUCING MODELING MATERIAL FOR 3D PRINTERS, AND THREE-DIMENSIONAL MODEL Konica Minolta, Inc. (JP) 2022-03-24 US disclosed