SCHEMBL8749262

SCHEMBL8749262

O=C(N1CCOCCN(C(=O)C23CC4CC(CC(C4)C2)C3)CCOCC1)C12CC3CC(CC(C3)C1)C2

nearest known ligand 0.80

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.80
HSD11B1 P28845 6/20 0.69
L3MBTL1 Q9Y468 1/20 0.69
LMNA P02545 2/20 0.55
ALDH1A1 P00352 2/20 0.55
SMN1; SMN2 Q16637 4/20 0.55
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
CNR2 P34972 1/20 0.53
TSHR P16473 1/20 0.53
HTT P42858 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53

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
SCHEMBL16064907 1.00 MAPK1 (0.80) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL8749301 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL8749177 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL8748863 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL8749263 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL6881683 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL8749079 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL6870643 0.98 MAPK1 (0.77) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL29860741 0.92 MAPK1 (0.73) MAPK1HSD11B1L3MBTL1LMNAALDH1A1
SCHEMBL8749195 0.91 MAPK1 (0.68) MAPK1HSD11B1L3MBTL1LMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0599928-B1 STABILIZED COMPLEX LIGANDS AND THEIR USE IN LIQUID CRYSTAL DISPLAYS HOECHST AG (DE) 1997-03-19 EP disclosed
US-5445762-A Stabilized complex ligands and their use in liquid crystal displays HOECHST AKTIENGESELLSCHAFT (DE) 1995-08-29 US disclosed
EP-0599928-A1 STABILIZED COMPLEX LIGANDS AND THEIR USE IN LIQUID CRYSTAL DISPLAYS. HOECHST AG (DE) 1994-06-08 EP disclosed
WO-1993004142-A1 STABILIZED COMPLEX LIGANDS AND THEIR USE IN LIQUID CRYSTAL DISPLAYS HOECHST AKTIENGESELLSCHAFT (DE) 1993-03-04 WO disclosed
EP-0528415-A1 Stabilized complex ligands and their use in liquid crystal displays HOECHST AKTIENGESELLSCHAFT (DE) 1993-02-24 EP disclosed