SCHEMBL11400960

SCHEMBL11400960

CC(c1ccccc1)c1ccccc1OP(O)Oc1ccccc1C(C)c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.42
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
KMT2A Q03164 1/20 0.38
IDO1 P14902 1/20 0.38
TDO2 P48775 1/20 0.38
ALDH1A1 P00352 2/20 0.33
LMNA P02545 2/20 0.33
ADRA2A P08913 1/20 0.33
ADRA2C P18825 1/20 0.33
HIF1A Q16665 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
TRPA1 O75762 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRD1 P41143 1/20 0.32
OPRK1 P41145 1/20 0.32
OPRL1 P41146 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32

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
SCHEMBL9941454 0.89 TYR (0.42) TYRMEN1MAPTCYP2C9KMT2A
SCHEMBL11263763 0.88 TDP1 (0.37) TYRMEN1MAPTCYP2C9KMT2A
SCHEMBL4900277 0.85 TYR (0.41) TYRMEN1MAPTCYP2C9KMT2A
SCHEMBL10413325 0.82 TYR (0.39) TYRMEN1MAPTCYP2C9KMT2A
SCHEMBL11249539 0.81 CYSLTR2 (0.40) MEN1MAPTKMT2ALMNAADRA2A
SCHEMBL10541465 0.79 TYR (0.46) TYRMEN1MAPTCYP2C9KMT2A
SCHEMBL10413327 0.79 TYR (0.37) TYRMEN1MAPTCYP2C9KMT2A
SCHEMBL5941442 0.79 IDO1 (0.56) TYRMEN1KMT2AIDO1TDO2
SCHEMBL28670888 0.79 IDO1 (0.56) TYRMEN1KMT2AIDO1TDO2
SCHEMBL19172035 0.79 TYR (0.44) TYRMEN1MAPTCYP2C9KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55106255-A None JP disclosed
JP-S55106255-A HALOGEN-CONTAINING RESIN COMPOSITION ADEKA ARGUS CHEM CO LTD 1980-08-14 JP disclosed