SCHEMBL9599556

SCHEMBL9599556

O=S(=O)(c1ccc(O)cc1)c1c(-c2ccccc2)cn2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.42
ALDH1A1 P00352 6/20 0.42
GAA P10253 5/20 0.42
MEN1 O00255 4/20 0.42
HPGD P15428 4/20 0.42
KMT2A Q03164 4/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
UQCRB P14927 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.37
HTR6 P50406 2/20 0.37
GFER P55789 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.36

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
SCHEMBL9598092 0.81 RAPGEF4 (0.49) KDM4EALDH1A1GAAMEN1KMT2A
SCHEMBL9599177 0.80 RAPGEF4 (0.41) KDM4EALDH1A1GAAMEN1HPGD
SCHEMBL9599413 0.78 L3MBTL1 (0.42) KDM4EALDH1A1GAAMEN1HPGD
SCHEMBL9597893 0.78 HRH3 (0.49) KDM4EALDH1A1GAAMEN1HPGD
SCHEMBL9598706 0.77 RAPGEF4 (0.39) KDM4EGAANPC1RAB9AUQCRB
SCHEMBL9566294 0.77 CA12 (0.44) KDM4EALDH1A1GAAMEN1HPGD
SCHEMBL9599595 0.75 RAPGEF4 (0.38) KDM4EALDH1A1GAAMEN1HPGD
SCHEMBL6636591 0.75 HRH3 (0.50) KDM4EALDH1A1GAAMEN1HPGD
SCHEMBL9599393 0.74 ESR1 (0.38) RAPGEF4HTR6ESR1LMNAHTT
SCHEMBL15307424 0.71 SMN1; SMN2 (0.40) KDM4EALDH1A1MEN1KMT2ANPC1

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