SCHEMBL8516638

SCHEMBL8516638

Cc1c(C(C)c2ccc(C(C)c3ccccc3)cc2)ccc(O)c1-c1c(O)ccc(S(=O)(=O)O)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.42
TNNI3 P19429 1/20 0.33
TNNT2 P45379 1/20 0.33
TNNC1 P63316 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
MAPT P10636 4/20 0.33
KMT2A Q03164 4/20 0.33
ALDH1A1 P00352 4/20 0.33
LMNA P02545 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
KDM4E B2RXH2 1/20 0.33
GMNN O75496 1/20 0.33
POLB P06746 1/20 0.33
HPGD P15428 1/20 0.33
PMP22 Q01453 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
MEN1 O00255 2/20 0.33
MAOA P21397 1/20 0.33
GAA P10253 3/20 0.32
HTT P42858 3/20 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
SCHEMBL8516824 0.97 TYR (0.44) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8516881 0.91 TYR (0.37) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8516648 0.89 TYR (0.38) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8516707 0.88 TYR (0.39) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8517744 0.83 TRPA1 (0.37) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8365939 0.82 VKORC1 (0.36) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8369631 0.81 TYR (0.46) TYRMAPTKMT2AALDH1A1LMNA
SCHEMBL8367574 0.79 VKORC1 (0.38) TYRTNNI3TNNT2TNNC1HKDC1
SCHEMBL8517228 0.78 NQO1 (0.41) TNNI3TNNT2TNNC1HKDC1MAPT
SCHEMBL8369538 0.77 TYR (0.49) TYRMAPTKMT2AALDH1A1LMNA

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
EP-0714785-B1 Sulfonated phenol (salt) containing color-developing agents and color-developing sheets MITSUI CHEMICALS INC (JP) 1999-01-07 EP 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