SCHEMBL11244840

SCHEMBL11244840

CC(c1ccccc1)c1ccc(OP(O)Oc2ccccc2C(C)(C)C)c(C(C)c2ccccc2)c1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.34
ATM Q13315 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
CYP2C19 P33261 1/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
GAA P10253 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
MAPT P10636 2/20 0.31
IDO1 P14902 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
NAMPT P43490 1/20 0.30
TP53 P04637 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
SCHEMBL11263763 0.89 TDP1 (0.37) TYRATMTDP1CYP1A2CYP3A4
SCHEMBL11261908 0.79 CYP1A2 (0.37) TYRCYP1A2CYP3A4CYP2C9TSHR
SCHEMBL9577447 0.77 TYR (0.40) TYRTDP1KDM4EALDH1A1MAPT
SCHEMBL11400960 0.77 TYR (0.42) TYRCYP2C9KDM4EALDH1A1MAPT
SCHEMBL11252515 0.77 CYP2C19 (0.35) TYRATMTDP1CYP1A2CYP3A4
SCHEMBL11254545 0.77 ALDH1A1 (0.45) ATMTDP1CYP1A2TSHRCYP2C19
SCHEMBL10413283 0.74 TYR (0.38) TYRTDP1KDM4E
SCHEMBL11249531 0.74 GAA (0.33) GAAMAPTTP53
SCHEMBL9491543 0.72 TDP1 (0.43) ATMTDP1CYP1A2TSHRCYP2C19
SCHEMBL10413285 0.72 TYR (0.36) TYRTDP1

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-4346025-A Stabilized vinyl chloride polymer comprising a phenylethylidene aryl phosphite ADEKA ARGUS CHEMICAL CO., LTD. (JP) 1982-08-24 US disclosed