SCHEMBL703946

SCHEMBL703946

CCOCCCCCOCCOCCS

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.43
MEN1 O00255 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
MAPT P10636 1/20 0.43
EPHX2 P34913 4/20 0.37
ALDH1A1 P00352 2/20 0.36
TSHR P16473 3/20 0.34
CYP3A4 P08684 1/20 0.32
CES2 O00748 1/20 0.31

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
SCHEMBL5932730 0.95 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL4795603 0.90 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL2190588 0.89
SCHEMBL20547673 0.89 ALDH1A1 (0.43) THRBALDH1A1TSHR
SCHEMBL5932497 0.87 THRB (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL29150457 0.87 THRB (0.39) THRBMEN1HTTKMT2AMAPT
SCHEMBL12924146 0.87 THRB (0.52) THRBMEN1HTTKMT2AMAPT
SCHEMBL12924144 0.87 THRB (0.52) THRBMEN1HTTKMT2AMAPT
SCHEMBL5319244 0.85 HTT (0.60) THRBMEN1HTTKMT2AMAPT
SCHEMBL5933467 0.84 ALDH1A1 (0.39) THRBMEN1HTTKMT2AMAPT

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 85 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11850237-B2 Compounds and methods for treating influenza ROMARK LABORATORIES L.C. (US) 2023-12-26 US disclosed
EP-2445349-B1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA ROMARK LABORATORIES LC (US) 2022-02-09 EP disclosed
EP-3895706-A1 THIAZOLINIDE COMPOUNDS FOR TREATING NON-INFLUENZA VIRAL INFECTIONS Romark Laboratories, L.C. (US) 2021-10-20 EP disclosed
US-20210177809-A1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA ROMARK LABORATORIES L.C. (US) 2021-06-17 US disclosed
US-10912768-B2 Compounds and methods for treating influenza ROMARK LABORATORIES L.C. (US) 2021-02-09 US disclosed
US-10577337-B2 Compositions and methods of treatment with prodrugs of tizoxanide, an analogue or salt thereof ROMARK LABORATORIES, L.C. (US) 2020-03-03 US disclosed
US-RE47786-E1 Haloalkyl heteroaryl benzamide compounds ROMARK LABORATORIES L.C. (US) 2019-12-31 US disclosed
US-20190307730-A1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA ROMARK LABORATORIES L.C. (US) 2019-10-10 US disclosed
US-20190276417-A1 COMPOSITIONS AND METHODS OF TREATMENT WITH PRODRUGS OF TIZOXANIDE, AN ANALOGUE OR SALT THEREOF ROMARK LABORATORIES, L.C. (US) 2019-09-12 US disclosed
US-10363243-B2 Compounds and methods for treating influenza ROMARK LABORATORIES L.C. (US) 2019-07-30 US disclosed
WO-2007008529-A2 CELULLAR CHOLESTEROL ABSORPTION MODIFIERS KALYPSYS, INC (US) 2007-01-18 WO disclosed
WO-2006124874-A2 INHIBITORS OF B-RAF KINASE KALYPSYS, INC. (US) 2006-11-23 WO disclosed
WO-2006124780-A2 IH-BENZO [D] IMIDAZOLE COMPOUNDS AS INHIBITORS OF B-RAF KINASE KALYPSYS, INC. (US) 2006-11-23 WO disclosed
US-20060252807-A1 Novel ortho-terphenyl inhibitors of p38 kinase and methods of treating inflammatory disorders KALYPSYS, INC. 2006-11-09 US disclosed
WO-2006116355-A1 ORTHO-TERPHENYL INHIBITORS OF P38 KINASE AND METHODS OF TREATING INFLAMMATORY DISORDERS KALYPSYS, INC. (US) 2006-11-02 WO disclosed
US-20060205736-A1 Sulfonyl-substituted bicyclic compounds as modulators of PPAR KALYPSYS, INC. 2006-09-14 US disclosed
US-20060167012-A1 Sulfonyl-substituted bicyclic compounds as modulators of PPAR KALYPSYS, INC. 2006-07-27 US disclosed
WO-2006060424-A2 INDUCIBLE NITRIC OXIDE SYNTHASE DIMERIZATION INHIBITORS KALYPSYS, INC. (US) 2006-06-08 WO disclosed
US-20060116515-A1 Inducible nitric oxide synthase dimerization inhibitors KALYPSYS, INC. 2006-06-01 US disclosed
WO-2006055187-A1 SULFONYL-SUBSTITUTED BICYCLIC COMPOUNDS AS MODULATORS OF PPAR KALYPSYS, INC. (US) 2006-05-26 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 (11 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-20060116515-A1 Inducible nitric oxide synthase dimerization inhibitors NOS3, NOS2, NOS1 THRB 1246/4885MEN1 4731/4885HTT 4845/4885
US-20060167012-A1 Sulfonyl-substituted bicyclic compounds as modulators of PPAR PPARG, PPARA, PPARD THRB 228/4885MEN1 4811/4885HTT 1602/4885
US-10912768-B2 Compounds and methods for treating influenza HIF1AN, HAVCR2, NEU1 THRB 3392/4885MEN1 3237/4885HTT 3110/4885
US-20060252807-A1 Novel ortho-terphenyl inhibitors of p38 kinase and methods of treating inflammatory disorders MAPK1, MAP3K1, MAPK4 THRB 1088/4885MEN1 3740/4885HTT 2882/4885
US-20210177809-A1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA HIF1AN, HAVCR2, NEU1 THRB 3392/4885MEN1 3237/4885HTT 3110/4885
US-20190307730-A1 COMPOUNDS AND METHODS FOR TREATING INFLUENZA HIF1AN, HAVCR2, NEU1 THRB 3392/4885MEN1 3237/4885HTT 3110/4885
US-11850237-B2 Compounds and methods for treating influenza HIF1AN, HAVCR2, NEU1 THRB 3392/4885MEN1 3237/4885HTT 3110/4885
US-20190276417-A1 COMPOSITIONS AND METHODS OF TREATMENT WITH PRODRUGS OF TIZOXANIDE, AN ANALOGUE OR SALT THEREOF TK1, SLC7A1, SI THRB 2183/4885MEN1 2641/4885HTT 4125/4885
US-10577337-B2 Compositions and methods of treatment with prodrugs of tizoxanide, an analogue or salt thereof TK1, SLC7A1, SI THRB 2183/4885MEN1 2641/4885HTT 4125/4885
US-10363243-B2 Compounds and methods for treating influenza HIF1AN, HAVCR2, NEU1 THRB 3392/4885MEN1 3237/4885HTT 3110/4885
US-20060205736-A1 Sulfonyl-substituted bicyclic compounds as modulators of PPAR PPARG, PPARA, PPARD THRB 228/4885MEN1 4811/4885HTT 1602/4885

“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.