SCHEMBL9599082

SCHEMBL9599082

Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)c3c(C)cn4ccccc34)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
ALDH1A1 P00352 4/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
MAPT P10636 1/20 0.40
ENPP2 Q13822 1/20 0.39
VDR P11473 1/20 0.39
LMNA P02545 3/20 0.38
RAPGEF4 Q8WZA2 2/20 0.38
MAPK1 P28482 1/20 0.38
CA12 O43570 2/20 0.37
CA2 P00918 2/20 0.37
PPARG P37231 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2D6 P10635 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
KEAP1 Q14145 1/20 0.37

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
SCHEMBL9599300 0.88 SMN1; SMN2 (0.40) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9598136 0.86 SMN1; SMN2 (0.39) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL4157574 0.86 ENPP2 (0.39) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9599413 0.86 L3MBTL1 (0.42) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9597646 0.85 ENPP1 (0.41) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9597622 0.83 ENPP1 (0.38) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9598810 0.82 ENPP3 (0.44) HTTSMN1; SMN2ALDH1A1MAPTENPP2
SCHEMBL8652435 0.81 SMN1; SMN2 (0.43) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL4635730 0.78 ALDH1A1 (0.43) HTTSMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL9598092 0.78 RAPGEF4 (0.49) ALDH1A1MEN1KMT2AENPP2RAPGEF4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-4957925-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS, TREATMENT OF ANGINA SANOFI (FR) 1990-09-18 US disclosed