SCHEMBL4070914

SCHEMBL4070914

CS(=O)(=O)NCCCCO

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
ALDH1A1 P00352 3/20 0.41
GRIA1 P42261 3/20 0.39
CA2 P00918 7/20 0.39
CA1 P00915 6/20 0.39
CA12 O43570 2/20 0.37
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
PPARA Q07869 2/20 0.37
TDP1 Q9NUW8 1/20 0.35
EPHX2 P34913 1/20 0.35
CA9 Q16790 1/20 0.33
MAPT P10636 1/20 0.33
EPHX1 P07099 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL9952157 0.98 GRIA1 (0.43) POLBALDH1A1GRIA1CA2CA1
SCHEMBL1447226 0.92
SCHEMBL12090531 0.87 POLB (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14739816 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14739515 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14740248 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14740061 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14739265 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14739086 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1
SCHEMBL14740296 0.84 GRIA1 (0.52) POLBALDH1A1GRIA1CA2CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023215989-A1 SULFUR-CONTAINING LIPIDS NANOVATION THERAPEUTICS INC. (CA) 2023-11-16 WO disclosed
EP-2560976-B9 FUROPYRIDINE COMPOUNDS AND USES THEREOF NOVARTIS AG (CH) 2017-06-07 EP disclosed
US-9081142-B2 Photosensitive resin composition for a color filter and uses thereof CHI MEI CORPORATION (TW) 2015-07-14 US disclosed
US-20140346416-A1 PHOTOSENSITIVE RESIN COMPOSITION FOR A COLOR FILTER AND USES THEREOF CHI MEI CORPORATION (TW) 2014-11-27 US disclosed
EP-2655362-A1 HEPATITIS C INHIBITORS AND USES THEREOF Abbvie Inc. (US) 2013-10-30 EP disclosed
WO-2012087833-A1 HEPATITIS C INHIBITORS AND USES THEREOF ABBOTT LABORATORIES (US) 2012-06-28 WO disclosed
EP-1653961-A4 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORP (US) 2009-04-01 EP disclosed
US-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 US disclosed
EP-1653961-A1 INHIBITORS OF AKT ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2006-05-10 EP disclosed
WO-2005011700-A1 INHIBITORS OF Akt ACTIVITY SMITHKLINE BEECHAM CORPORATION (US) 2005-02-10 WO disclosed
US-5659065-A CHEMICAL INTERMEDIATES FOR MEDICINAL ACTIVE AGENTS NOVARTIS CORPORATION (US) 1997-08-19 US disclosed
EP-0678500-A1 Alpha-amino alkanoic acids and reduction products as intermediates in the preparation of renin inhibitors CIBA-GEIGY AG (CH) 1995-10-25 EP 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-20080255143-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 POLB 1321/4885ALDH1A1 4166/4885GRIA1 3022/4885

“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.