SCHEMBL4174907

SCHEMBL4174907

CC(C)c1cn2ccccc2c1S(=O)(=O)c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAPGEF4 Q8WZA2 1/20 0.39
ESR1 P03372 1/20 0.37
SMN1; SMN2 Q16637 4/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
TP53 P04637 1/20 0.35
PKM P14618 1/20 0.35
HSD11B1 P28845 1/20 0.34
KDM4E B2RXH2 3/20 0.33
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
GFER P55789 2/20 0.33
HDAC6 Q9UBN7 1/20 0.33
ENPP2 Q13822 1/20 0.33
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
HTT P42858 1/20 0.32

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 0.82 RAPGEF4 (0.49) RAPGEF4ESR1GAAPKMKDM4E
SCHEMBL9599177 0.81 RAPGEF4 (0.41) RAPGEF4ESR1GAAPKMKDM4E
SCHEMBL9260775 0.81 RAPGEF4 (0.44) RAPGEF4ESR1SMN1; SMN2GAAMAPT
SCHEMBL9598706 0.79 RAPGEF4 (0.39) RAPGEF4ESR1GAAPKMHSD11B1
SCHEMBL4157574 0.79 ENPP2 (0.39) SMN1; SMN2GAAMAPTENPP2ALDH1A1
SCHEMBL4171578 0.78 HRH3 (0.37) SMN1; SMN2TP53PKMKDM4ENPC1
SCHEMBL7266691 0.78 RAPGEF4 (0.38) RAPGEF4ESR1SMN1; SMN2GAAMAPT
SCHEMBL9599556 0.77 KDM4E (0.42) RAPGEF4ESR1SMN1; SMN2GAAMAPT
SCHEMBL8940978 0.77 HRH3 (0.37) SMN1; SMN2TP53PKMKDM4ENPC1
SCHEMBL9599595 0.77 RAPGEF4 (0.38) RAPGEF4ESR1GAAPKMKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0235111-B1 INDOLIZINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND COMPOSITIONS CONTAINING THEM SANOFI S.A. (FR) 1991-04-10 EP claimed
US-20090017112-A1 Compounds for Inhibiting Beta-Amyloid Production ROSKAMP RESEARCH LLC (US) 2009-01-15 US disclosed
EP-1993548-A2 COMPOUNDS FOR INHIBITING BETA-AMYLOID PRODUCTION Roskamp Research LLC (US) 2008-11-26 EP disclosed
WO-2007103683-A2 COMPOUNDS FOR INHIBITING BETA-AMYLOID PRODUCTION ROSKAMP RESEARCH LLC (US) 2007-09-13 WO disclosed
US-5739340-A Indolizine derivatives with pharmaceutical activity ELF SANOFI (FR) 1998-04-14 US disclosed
US-5403933-A Chemical intermediates for cardiotonic, hypotensive, antiarrhymia and bradycadial agents; cognition activators ELF SANOFI (FR) 1995-04-04 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-4957925-A HYPOTENSIVE AGENTS, ANTIARRHYTHMIA AGENTS, TREATMENT OF ANGINA SANOFI (FR) 1990-09-18 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090017112-A1 Compounds for Inhibiting Beta-Amyloid Production PSEN1, PSEN2, APP RAPGEF4 2380/4885ESR1 4337/4885SMN1; SMN2 700/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.