SCHEMBL9766543

SCHEMBL9766543

O=S(=O)(O)c1cccc(-c2ccccc2-c2cccc(S(=O)(=O)O)c2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
ALDH1A1 P00352 1/20 0.53
HSD17B10 Q99714 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
BRD4 O60885 4/20 0.43
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
CA12 O43570 1/20 0.42
CA9 Q16790 1/20 0.42
PTGS2 P35354 1/20 0.42
HDAC6 Q9UBN7 1/20 0.41
IKBKB O14920 1/20 0.41
AKR1C3 P42330 1/20 0.40
SNCA P37840 1/20 0.40
NAPRT Q6XQN6 1/20 0.39
KAT6A Q92794 2/20 0.39
APP P05067 1/20 0.39
MMP1 P03956 1/20 0.39
MMP2 P08253 1/20 0.39

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
SCHEMBL5305260 0.96 TSHR (0.56) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL6846678 0.89 ALDH1A1 (0.50) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL9766560 0.87 TSHR (0.50) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL308891 0.87 KAT6A (0.53) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL308372 0.87 KAT6A (0.53) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL27787846 0.87 TSHR (0.46) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL975190 0.87 TSHR (0.61) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL307044 0.85 TSHR (0.62) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL1416443 0.85 TSHR (0.59) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1
SCHEMBL15509798 0.85 TSHR (0.59) TSHRSMN1; SMN2ALDH1A1HSD17B10TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5008472-A Preparation of 4,4\"-dihydroxyterphenyl BASF AKTIENGESELLSCHAFT (DE) 1991-04-16 US claimed
JP-2121939-A None JP disclosed
EP-3131868-A1 Process for the manufacture of terphenyl compounds Solvay Specialty Polymers USA, L.L.C. (US) 2017-02-22 EP disclosed
EP-3116846-A1 PROCESS FOR THE MANUFACTURE OF TERPHENYL COMPOUNDS Solvay Specialty Polymers USA, LLC. (US) 2017-01-18 EP disclosed
WO-2015158580-A1 Process for the manufacture of terphenyl compounds SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2015-10-22 WO disclosed
WO-2015136015-A1 PROCESS FOR THE MANUFACTURE OF TERPHENYL COMPOUNDS SOLVAY SPECIALTY POLYMERS USA, LLC (US) 2015-09-17 WO disclosed
US-5008472-A Preparation of 4,4\"-dihydroxyterphenyl BASF AKTIENGESELLSCHAFT (DE) 1991-04-16 US disclosed
JP-H02121939-A PRODUCTION OF 4,4\"-DHIHYDROXYTERPHENYL BASF AG 1990-05-09 JP disclosed
EP-0360092-A1 Process for preparing 4,4\"-dihydroxyterphenyl BASF Aktiengesellschaft (DE) 1990-03-28 EP disclosed