SCHEMBL22201769

SCHEMBL22201769

CCOCC1CC2CCCC1CC2COC(=O)Cc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.47
MAPT P10636 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PAM P19021 1/20 0.41
TSHR P16473 1/20 0.40
GLA P06280 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
CYP3A4 P08684 1/20 0.38
ACE P12821 1/20 0.38
ALOX15 P16050 1/20 0.38

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
SCHEMBL22201799 0.78 MGLL (0.44) MGLLMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL19020351 0.72 MGLL (0.51) MGLLMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL14274359 0.71 ALDH1A1 (0.59) MGLLMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL29071173 0.71 MGLL (0.52) MGLLMAPTALDH1A1MAPK1L3MBTL1
SCHEMBL1332625 0.70 ALDH1A1 (0.68) MAPTALDH1A1MAPK1L3MBTL1PAM
SCHEMBL112999 0.70 ALDH1A1 (0.68) MAPTALDH1A1MAPK1L3MBTL1PAM
Benzene SCHEMBL28160801 0.70 ALDH1A1 (0.68) MAPTALDH1A1MAPK1L3MBTL1PAM
SCHEMBL1873977 0.70 ALDH1A1 (0.68) MAPTALDH1A1MAPK1L3MBTL1PAM
SCHEMBL28392236 0.70 ALDH1A1 (0.54) ALDH1A1MAPK1L3MBTL1PAMTSHR
SCHEMBL2905585 0.70 MGLL (0.55) MGLLMAPTALDH1A1MAPK1L3MBTL1

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-20200216670-A1 THERMOSETTING SILICON-CONTAINING COMPOUND, COMPOSITION FOR FORMING A SILICON-CONTAINING FILM, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-07-09 US disclosed