SCHEMBL8600889

SCHEMBL8600889

CC(=CCCN1CCOCC1)C(=O)O.CC(=CCCO)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.44
ALDH1A1 P00352 6/20 0.43
KDM4E B2RXH2 5/20 0.43
HSD17B10 Q99714 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
PAOX Q6QHF9 1/20 0.38
KMT2A Q03164 4/20 0.37
MEN1 O00255 2/20 0.37
MAPT P10636 2/20 0.37
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.36

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
SCHEMBL39611 0.94 GLA (0.49) GLAALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL887123 0.94 GLA (0.49) GLAALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL317495 0.86 GLA (0.40) GLAALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL317493 0.86 GLA (0.40) GLAALDH1A1KDM4EHSD17B10SMN1; SMN2
Oxirane SCHEMBL1904542 0.82 CD81 (0.39) SMN1; SMN2
SCHEMBL504158 0.82 CD81 (0.39) ALDH1A1HSD17B10PAOXRAB9A
SCHEMBL5682570 0.82 CD81 (0.39) ALDH1A1HSD17B10PAOXRAB9A
SCHEMBL7106370 0.80 GLA (0.43) GLAALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL6449843 0.80 GAA (0.46) GLAALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL1275573 0.79 CYP1A2 (0.41) ALDH1A1KDM4EHSD17B10SMN1; SMN2MAPT

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
EP-0527992-B1 PROCESS FOR MODIFYING THE SURFACE OF MOULDINGS IN THE FORM OF MICROPOROUS MEMBRANES, MOULDINGS SO PRODUCED AND THEIR USE FOR SEPARATING SUBSTANCES BY ADSORPTION SARTORIUS GMBH (DE) 1998-02-18 EP disclosed
EP-0527992-A1 PROCESS FOR MODIFYING THE SURFACE OF MOULDINGS IN THE FORM OF MICROPOROUS MEMBRANES, MOULDINGS SO PRODUCED AND THEIR USE FOR SEPARATING SUBSTANCES BY ADSORPTION SARTORIUS AG (DE) 1993-02-24 EP disclosed
WO-1992015637-A2 PROCESS FOR MODIFYING THE SURFACE OF MOULDINGS, MOULDINGS SO PRODUCED AND THEIR USE FOR SEPARATING SUBSTANCES BY ADSORPTION SARTORIUS AG (DE) 1992-09-17 WO disclosed