SCHEMBL11099503

SCHEMBL11099503

COc1ccccc1-c1ccccc1-c1ccccc1-c1ccccc1OC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.67
CA2 P00918 3/20 0.67
CA7 P43166 2/20 0.67
CA9 Q16790 2/20 0.67
CA12 O43570 1/20 0.67
CA4 P22748 1/20 0.67
CA14 Q9ULX7 1/20 0.67
APP P05067 1/20 0.62
ALDH1A1 P00352 7/20 0.58
HTR7 P34969 4/20 0.55
PTPRC P08575 1/20 0.53
PTPN1 P18031 1/20 0.53
TDP1 Q9NUW8 3/20 0.52
TP53 P04637 1/20 0.52
TSHR P16473 1/20 0.52
ADRA2B P18089 1/20 0.52
PTGS1 P23219 1/20 0.52
HPGD P15428 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
KDM4E B2RXH2 2/20 0.50

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
SCHEMBL30599266 1.00 CA1 (0.67) CA1CA2CA7CA9CA12
SCHEMBL3643541 1.00 CA1 (0.67) CA1CA2CA7CA9CA12
SCHEMBL29429633 0.97 CA1 (0.71) CA1CA2CA7CA9CA12
SCHEMBL29788337 0.97 CA1 (0.71) CA1CA2CA7CA9CA12
SCHEMBL301996 0.97 CA1 (0.71) CA1CA2CA7CA9CA12
SCHEMBL29740506 0.94 CA1 (0.67) CA1CA2CA7CA9CA12
SCHEMBL8592244 0.89 CA1 (0.60) CA1CA2CA7CA9CA12
SCHEMBL29518802 0.88 ALDH1A1 (0.55) CA1CA2CA7CA9CA12
SCHEMBL619334 0.88 ALDH1A1 (0.55) CA1CA2CA7CA9CA12
SCHEMBL13211665 0.88 PTPRC (0.55) CA1CA2CA7CA9CA12

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-4449003-A Process for the production of bis(4-hydroxyphenyl)biphenyl disulfone MOBAY CHEMICAL CORPORATION (US) 1984-05-15 US disclosed