SCHEMBL17877182

SCHEMBL17877182

CC(C)C(C)(C)Oc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 1/20 0.41
▸ CA4 P22748 1/20 0.40
▸ LMNA P02545 1/20 0.39
▸ RIPK1 Q13546 3/20 0.38
▸ LTA4H P09960 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ATM Q13315 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ MAOA P21397 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ CYP2D6 P10635 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ PPARG P37231 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ CYP1A2 P05177 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
SCHEMBL27809459 0.82 CA4 (0.37) MAPK1CA4LMNARIPK1LTA4H
SCHEMBL11663267 0.82 LMNA (0.45) MAPK1CA4LMNALTA4HTSHR
SCHEMBL11600687 0.82 RIPK1 (0.39) MAPK1CA4LMNARIPK1LTA4H
SCHEMBL24225606 0.77 ALDH1A1 (0.37) MAPK1L3MBTL1MAOACYP2D6ALDH1A1
SCHEMBL17299692 0.77 PPARA (0.50) MAPK1LMNATSHRATMCYP2D6
SCHEMBL11705596 0.77 CYP2D6 (0.38) MAPK1CA4LMNARIPK1LTA4H
SCHEMBL20222969 0.74 CA4 (0.39) CA4LMNARIPK1LTA4HTSHR
SCHEMBL4224012 0.74 CA4 (0.48) MAPK1CA4LMNARIPK1LTA4H
SCHEMBL1660600 0.74 CA4 (0.48) MAPK1CA4RIPK1LTA4HTSHR
SCHEMBL93074 0.74 CA4 (0.48) MAPK1CA4RIPK1LTA4HTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220024906-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY NOVARTIS PHARMA AG (CH) 2022-01-27 — — US disclosed
WO-2021158781-A1 METHODS FOR PRACTICAL SYNTHESIS OF DEUTERATED AMINO ACIDS ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) 2021-08-12 — — WO disclosed
US-20200181142-A1 Derivatives And Methods Of Treating Hepatitis B Infections NOVIRA THERAPEUTICS INC (US) 2020-06-11 — — US disclosed
US-10544141-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2020-01-28 — — US disclosed
US-20190077800-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2019-03-14 — — US disclosed
US-10189835-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2019-01-29 — — US disclosed
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2018-05-10 — — US disclosed
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2018-05-10 — — US disclosed
US-9890161-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2018-02-13 — — US disclosed
US-9890161-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2018-02-13 — — US disclosed
US-20170121328-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2017-05-04 — — US disclosed
US-20170121328-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2017-05-04 — — US disclosed
US-20170121329-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2017-05-04 — — US disclosed
US-9550779-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2017-01-24 — — US disclosed
US-9550779-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2017-01-24 — — US disclosed
US-9527845-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2016-12-27 — — US disclosed
US-9518057-B2 Derivatives and methods of treating hepatitis B infections NOVIRA THERAPEUTICS, INC. (US) 2016-12-13 — — US disclosed
US-20160185779-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2016-06-30 — — US disclosed
US-20160185778-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2016-06-30 — — US disclosed
US-20160185777-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS NOVIRA THERAPEUTICS, INC. 2016-06-30 — — 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 (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-20190077800-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-10189835-B2 Derivatives and methods of treating hepatitis B infections HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20220024906-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY STING1, CGAS, IRF3 MAPK1 1593/4885CA4 3498/4885LMNA 2339/4885
US-20200181142-A1 Derivatives And Methods Of Treating Hepatitis B Infections HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20170121329-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20160185777-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20170121328-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20160185778-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-10544141-B2 Derivatives and methods of treating hepatitis B infections HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20180127415-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885
US-20160185779-A1 DERIVATIVES AND METHODS OF TREATING HEPATITIS B INFECTIONS HAVCR2, PYGL, HCCS MAPK1 3724/4885CA4 3719/4885LMNA 1546/4885

“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.

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