SCHEMBL2334837

SCHEMBL2334837

CCOC(=O)c1ccc(-c2c(C(F)(F)F)oc3cc(O)ccc3c2=O)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 6/20 0.67
ESR2 Q92731 5/20 0.67
ALDH1A1 P00352 4/20 0.51
LMNA P02545 2/20 0.51
TSHR P16473 1/20 0.51
AKR1B1 P15121 1/20 0.50
PSD A5PKW4 1/20 0.50
POLB P06746 2/20 0.48
JAK2 O60674 1/20 0.47
JAK1 P23458 1/20 0.47
TYK2 P29597 1/20 0.47
JAK3 P52333 1/20 0.47
KDM4E B2RXH2 2/20 0.46
TTR P02766 1/20 0.46
PPARG P37231 1/20 0.46
MEN1 O00255 2/20 0.46
CYP1A2 P05177 2/20 0.46
HPGD P15428 2/20 0.46
CYP2C19 P33261 2/20 0.46
KMT2A Q03164 2/20 0.46

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
SCHEMBL2334482 0.84 ALDH1A1 (0.52) ESR1ESR2ALDH1A1LMNATSHR
SCHEMBL2334656 0.83 ESR1 (0.77) ESR1ESR2ALDH1A1LMNAPSD
SCHEMBL2182106 0.83 ESR1 (0.90) ESR1ESR2ALDH1A1LMNAPSD
SCHEMBL2330828 0.82 PPARG (0.54) ESR1ESR2ALDH1A1LMNATSHR
SCHEMBL2331643 0.82 ESR1 (0.71) ESR1ESR2ALDH1A1LMNAPSD
SCHEMBL2335169 0.81 ESR1 (0.69) ESR1ESR2ALDH1A1LMNATSHR
SCHEMBL13835591 0.81 ESR1 (0.60) ESR1ESR2ALDH1A1LMNAPSD
SCHEMBL3957035 0.81 ESR1 (1.00) ESR1ESR2ALDH1A1LMNAPSD
SCHEMBL2334006 0.81 ESR1 (0.72) ESR1ESR2ALDH1A1LMNAPSD
SCHEMBL14156937 0.79 ESR1 (0.64) ESR1ESR2ALDH1A1LMNAPSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9717706-B2 Chromone inhibitors of S-nitrosoglutathione reductase NIVALIS THERAPEUTICS, INC. (US) 2017-08-01 US disclosed
US-20150352073-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase N30 PHARMACEUTICALS, LLC 2015-12-10 US disclosed
US-20140163092-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase N30 PHARMACEUTICALS, INC. (US) 2014-06-12 US disclosed
EP-2533637-B1 CHROMONE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE N30 PHARMACEUTICALS INC (US) 2014-03-26 EP disclosed
US-8669381-B2 Chromone inhibitors of S-nitrosoglutathione reductase N30 PHARMACEUTICALS, INC. (US) 2014-03-11 US disclosed
US-20130274320-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase NIVALIS THERAPEUTICS, INC. 2013-10-17 US disclosed
US-8481590-B2 Chromone inhibitors of S-nitrosoglutathione reductase N30 PHARMACEUTICALS, INC. (US) 2013-07-09 US disclosed
EP-2533637-A1 CHROMONE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE N30 Pharmaceuticals, Inc. (US) 2012-12-19 EP disclosed
US-20120295966-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase N30 PHARMACEUTICALS, LLC (US) 2012-11-22 US disclosed
WO-2011099978-A1 CHROMONE INHIBITORS OF S-NITROSOGLUTATHIONE REDUCTASE N30 PHARMACEUTICALS, LLC (US) 2011-08-18 WO 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 (4 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-20150352073-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase POR, GSR, CBR1 ESR1 768/4885ESR2 695/4885ALDH1A1 363/4885
US-20130274320-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase POR, GSR, CBR1 ESR1 768/4885ESR2 695/4885ALDH1A1 363/4885
US-20140163092-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase POR, GSR, CBR1 ESR1 768/4885ESR2 695/4885ALDH1A1 363/4885
US-20120295966-A1 Chromone Inhibitors of S-Nitrosoglutathione Reductase POR, GSR, CBR1 ESR1 768/4885ESR2 695/4885ALDH1A1 363/4885

“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.