SCHEMBL8370490

SCHEMBL8370490

CC(c1ccccc1)c1ccc(C(C)c2ccc(O)c(S(=O)(=O)O)c2O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.46
FABP3 P05413 1/20 0.36
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
ALDH1A1 P00352 3/20 0.36
KMT2A Q03164 2/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
GMNN O75496 1/20 0.36
POLB P06746 1/20 0.36
HPGD P15428 1/20 0.36
PMP22 Q01453 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ESR1 P03372 2/20 0.35
PDCD1 Q15116 1/20 0.35
ESR2 Q92731 1/20 0.35
CD274 Q9NZQ7 1/20 0.35
VKORC1 Q9BQB6 1/20 0.34

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
SCHEMBL8367499 0.97 TYR (0.49) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8369631 0.88 TYR (0.46) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8367579 0.87 TYR (0.42) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8369538 0.85 TYR (0.49) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8365926 0.85 TYR (0.45) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8369817 0.85 TYR (0.40) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8365872 0.85 TYR (0.43) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8370447 0.84 TYR (0.44) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8367571 0.81 TYR (0.47) TYRFABP3FABP4FABP5ALDH1A1
SCHEMBL8367616 0.81 TYR (0.45) TYRFABP3FABP4FABP5ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0714785-B1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI CHEMICALS INC (JP) 1999-01-07 EP disclosed
US-5647896-A MULTIVALENT SALT OF A SALICYLIC ACID DERIVATIVE, SULFONATED PHENOL MITSUI TOATSU CHEMICALS, INC. (JP) 1997-07-15 US disclosed
EP-0714785-A1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1996-06-05 EP disclosed