SCHEMBL1047374

SCHEMBL1047374

Cc1ccc(-c2cc(F)ccc2F)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.50
PTGS2 P35354 5/20 0.46
PTGS1 P23219 2/20 0.44
NFE2L2 Q16236 3/20 0.43
GCGR P47871 1/20 0.41
MAPK14 Q16539 1/20 0.41
MAOB P27338 2/20 0.41
PIM1 P11309 1/20 0.41
SRC P12931 1/20 0.41
GSK3A P49840 1/20 0.41
KDM4E B2RXH2 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RPS6KA3 P51812 1/20 0.40
AR P10275 1/20 0.40
HPGD P15428 1/20 0.39
PPARG P37231 1/20 0.39
MCL1 Q07820 1/20 0.39
PTK2B Q14289 1/20 0.39

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
SCHEMBL24428623 0.86 PIM1 (0.50) ACHEPTGS2PTGS1NFE2L2MAOB
SCHEMBL24766983 0.86 CA3 (0.44) PTGS2PTGS1NFE2L2MAOBRPS6KA3
SCHEMBL29892794 0.84 PTGS2 (0.47) ACHEPTGS2PTGS1NFE2L2PIM1
SCHEMBL10094630 0.83 ACHE (0.50) ACHEPTGS2PTGS1NFE2L2GCGR
SCHEMBL1046583 0.83 ACHE (0.50) ACHEPTGS2PTGS1NFE2L2GCGR
SCHEMBL12011032 0.81 PTGS2 (0.57) ACHEPTGS2PTGS1NFE2L2GCGR
SCHEMBL7870739 0.81 PTGS2 (0.44) PTGS2PTGS1NFE2L2PIM1SRC
SCHEMBL17110104 0.81 ACHE (0.48) ACHEPTGS2PTGS1NFE2L2GCGR
SCHEMBL10304724 0.79 PTGS2 (0.47) PTGS2PTGS1
SCHEMBL22294759 0.79 PTGS2 (0.43) ACHEPTGS2PTGS1NFE2L2GCGR

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
EP-4209491-A1 ENANTIOMERS OF SUBSTITUTED THIAZOLES AS ANTIVIRAL COMPOUNDS Innovative Molecules GmbH (DE) 2023-07-12 EP disclosed
EP-3692039-B1 ENANTIOMERS OF SUBSTITUTED THIAZOLES AS ANTIVIRAL COMPOUNDS INNOVATIVE MOLECULES GMBH (DE) 2022-12-14 EP disclosed
US-20220152008-A1 Enantiomers Of Substituted Thiazoles As Antiviral Compounds INNOVATIVE MOLECULES GMBH (DE) 2022-05-19 US disclosed
EP-3440063-B1 AMINOTHIAZOLE DERIVATIVES USEFUL AS ANTIVIRAL AGENTS INNOVATIVE MOLECULES GMBH (DE) 2020-08-05 EP disclosed
US-10590094-B2 Aminothiazole derivatives useful as antiviral agents INNOVATIVE MOLECULES GMBH (DE) 2020-03-17 US disclosed
US-20190112285-A1 Aminothiazole Derivatives Useful As Antiviral Agents INNOVATIVE MOLECULES GMBH (DE) 2019-04-18 US disclosed
WO-2019068817-A1 ENANTIOMERS OF SUBSTITUTED THIAZOLES AS ANTIVIRAL COMPOUNDS INNOVATIVE MOLECULES GMBH (DE) 2019-04-11 WO disclosed
US-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-23 US disclosed
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 US disclosed
WO-2016086200-A9 4,5,6,7-TETRAHYDRO-1 H-PYRAZOLO[4,3-C]PYRIDIN-3-AMINE COMPOUNDS AS CBP AND/OR EP300 INHIBITORS GENENTECH, INC. (US) 2016-06-23 WO disclosed
US-8987304-B2 Antituberculous composition comprising oxazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-03-24 US disclosed
US-8952207-B2 Copper-catalyzed C—H bond arylation THE UNIVERSITY OF HOUSTON SYSTEM (US) 2015-02-10 US disclosed
US-8952207-B2 Copper-catalyzed C—H bond arylation THE UNIVERSITY OF HOUSTON SYSTEM (US) 2015-02-10 US disclosed
US-8952207-B2 Copper-catalyzed C—H bond arylation THE UNIVERSITY OF HOUSTON SYSTEM (US) 2015-02-10 US disclosed
EP-2269694-A2 Antituberculous composition comprising oxazole compounds OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-01-05 EP disclosed
US-20090275528-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2009-11-05 US disclosed
US-20090076266-A1 COPPER-CATALYZED C-H BOND ARYLATION THE UNIVERSITY OF HOUSTON SYSTEM (US) 2009-03-19 US disclosed
US-20090076266-A1 COPPER-CATALYZED C-H BOND ARYLATION THE UNIVERSITY OF HOUSTON SYSTEM (US) 2009-03-19 US disclosed
US-20090076266-A1 COPPER-CATALYZED C-H BOND ARYLATION THE UNIVERSITY OF HOUSTON SYSTEM (US) 2009-03-19 US disclosed
WO-2003061652-A1 3-(IMIDAZOLYL)-2-ALKOXYPROPANOIC ACIDS AS TAFIA INHIBITORS PFIZER LIMITED (GB) 2003-07-31 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 (6 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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 ACHE 4103/4885PTGS2 2857/4885PTGS1 2097/4885
US-20190112285-A1 Aminothiazole Derivatives Useful As Antiviral Agents MAVS, EIF2AK2, SARS1 ACHE 4641/4885PTGS2 2691/4885PTGS1 2031/4885
US-20220152008-A1 Enantiomers Of Substituted Thiazoles As Antiviral Compounds EIF2AK2, MAVS, ZC3HAV1 ACHE 4546/4885PTGS2 3182/4885PTGS1 2976/4885
US-20090275528-A1 ANTITUBERCULOUS COMPOSITION COMPRISING OXAZOLE COMPOUNDS OXA1L, ARG1, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ACHE 2191/4885PTGS2 2713/4885PTGS1 1542/4885
US-20090076266-A1 COPPER-CATALYZED C-H BOND ARYLATION AOC2, AOC3, DBH ACHE 3552/4885PTGS2 2323/4885PTGS1 2445/4885
US-10590094-B2 Aminothiazole derivatives useful as antiviral agents MAVS, EIF2AK2, SARS1 ACHE 4641/4885PTGS2 2691/4885PTGS1 2031/4885

“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.