SCHEMBL11685337

SCHEMBL11685337

CCOC(CN(CC(OC=O)OCC)c1ccccc1)OC=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.36
TSHR P16473 2/20 0.35
ALDH1A1 P00352 5/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
NPY1R P25929 1/20 0.33
NPY2R P49146 1/20 0.33
ALDH3A1 P30838 1/20 0.33
ALDH1A3 P47895 1/20 0.33
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
TP53 P04637 2/20 0.32
GLA P06280 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 2/20 0.30
KMT2A Q03164 2/20 0.30
NR1I2 O75469 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NOX1 Q9Y5S8 1/20 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
SCHEMBL11207907 0.94 TSHR (0.40) L3MBTL1TSHRALDH1A1MAPTNPY1R
SCHEMBL11215767 0.89 EGFR (0.39) L3MBTL1TSHRALDH1A1LMNAMAPT
SCHEMBL11687133 0.84 RECQL (0.35) ALDH1A1LMNAMAPTTP53GLA
SCHEMBL10990457 0.84 TSHR (0.33) TSHRALDH1A1MAPTALDH3A1ALDH1A3
SCHEMBL11672899 0.79 ATM (0.32) L3MBTL1ALDH1A1LMNATP53MEN1
SCHEMBL10996027 0.79 CYP3A4 (0.36) TSHRALDH1A1LMNANPY1RNPY2R
SCHEMBL11671708 0.78 TSHR (0.39) L3MBTL1TSHRALDH1A1MAPTALDH3A1
SCHEMBL7439630 0.75 TSHR (0.35) L3MBTL1TSHRMAPTPPARGPPARA
SCHEMBL11670538 0.74 CNR2 (0.39) ALDH1A1LMNAMAPTTP53MEN1
SCHEMBL11212775 0.72 TSHR (0.42) L3MBTL1TSHRALDH1A1MAPTNPY1R

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-4022763-A Sulfaphenyl-azo-phenyl-azo-aminophenyl dyestuffs BAYER AKTIENGESELLSCHAFT (DT) 1977-05-10 US disclosed