SCHEMBL7274396

SCHEMBL7274396

CC(C)n1c(S(=O)(=O)c2ccc(OCc3ccccc3)cc2)nc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA5A P35218 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
TP53 P04637 3/20 0.46
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
FFAR1 O14842 1/20 0.44
PPARA Q07869 1/20 0.44
CTRC Q99895 1/20 0.42
ADAMTS4 O75173 2/20 0.42
MMP13 P45452 2/20 0.42
AR P10275 2/20 0.41

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
SCHEMBL7266014 0.81 KMT2A (0.50) POLBMEN1KMT2ATP53SMN1; SMN2
SCHEMBL7108878 0.73 CA12 (0.74) MEN1KMT2ACA12CA1CA2
SCHEMBL9260073 0.72 CA12 (0.72) CA12CA1CA2CA4CA5A
SCHEMBL8581163 0.72 CTRC (0.60) CA12CA1CA2CA4CA5A
SCHEMBL21142712 0.72 POLB (1.00) POLBMEN1KMT2ATP53CYP1A2
SCHEMBL13588852 0.70 CA12 (0.64) CA12CA1CA2CA4CA5A
SCHEMBL32679291 0.69 ALDH3A1 (0.61) POLBMEN1KMT2ACA12CA1
SCHEMBL6804801 0.68 POLB (0.71) POLBMEN1KMT2ATP53CYP1A2
SCHEMBL419556 0.68 LMNA (0.73) MEN1KMT2ACA12CA1CA2
SCHEMBL7830850 0.68 CA12 (0.66) MEN1KMT2ACA12CA1CA2

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
EP-0302793-B1 Aralkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same SANOFI ELF (FR) 1993-12-15 EP disclosed
US-5215988-A Treating angina, hypertension, arrhythmia, cerebral vascular insufficiency SANOFI (FR) 1993-06-01 US disclosed
US-5182291-A Angina pectoris, hypotensive, antiarrhythmia, cerebral vascular insufficiency SANOFI (FR) 1993-01-26 US disclosed
US-5147878-A Hypotensive, antiarrhythmia agents SANOFI (FR) 1992-09-15 US disclosed
US-5039700-A Cardiovascular disorders, antitumor agents SANOFI (FR) 1991-08-13 US disclosed
US-5017579-A Use of aminoalkoxyphenyl derivatives for reducing and/or controlling excessive intraocular pressure SANOFI (FR) 1991-05-21 US disclosed
US-4994474-A Hypotensive agents SANOFI (FR) 1991-02-19 US disclosed
US-4957925-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS, TREATMENT OF ANGINA SANOFI (FR) 1990-09-18 US disclosed
EP-0302793-A2 Aralkylaminoalkoxyphenyl derivatives, process of preparation and compositions containing the same ELF SANOFI (FR) 1989-02-08 EP disclosed