SCHEMBL3118443

SCHEMBL3118443

NC(=NC(=O)/C=C/c1ccccc1)NC(=O)c1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.62
▸ MAPT P10636 5/20 0.48
▸ NPC1 O15118 3/20 0.48
▸ RAB9A P51151 3/20 0.48
▸ NFKB1 P19838 1/20 0.48
▸ NFKB2 Q00653 1/20 0.48
▸ RELA Q04206 1/20 0.48
▸ HTT P42858 1/20 0.48
▸ LMNA P02545 4/20 0.47
▸ PLIN1 O60240 2/20 0.47
▸ RECQL P46063 2/20 0.47
▸ PLIN5 Q00G26 2/20 0.47
▸ ABHD5 Q8WTS1 2/20 0.47
▸ BCHE P06276 1/20 0.47
▸ TNFRSF1A P19438 1/20 0.47
▸ ACHE P22303 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ CYP1B1 Q16678 1/20 0.47
▸ ALDH1A1 P00352 5/20 0.46
▸ PLA2G7 Q13093 1/20 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
SCHEMBL14504234 1.00 CYP1A2 (0.62) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL27689932 0.85 HTT (0.62) CYP1A2MAPTNPC1RAB9AHTT
SCHEMBL27689875 0.80 TDP1 (0.49) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL27689878 0.79 MMP1 (0.58) CYP1A2MAPTHTTLMNAPLIN1
SCHEMBL27689904 0.78 KMT2A (0.48) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL1949536 0.77 MAPT (0.55) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL27709705 0.77 TDP1 (0.52) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL27709603 0.77 EGFR (0.60) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL27709606 0.77 HTT (0.48) CYP1A2MAPTNPC1RAB9ANFKB1
SCHEMBL143083 0.76 MAPT (0.66) MAPTNPC1RAB9AHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2617709-B1 Guanidine derivatives as antiviral agents BIOTRON LTD (AU) 2022-11-16 — — EP claimed
US-11192863-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2021-12-07 — — US claimed
US-10683263-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2020-06-16 — — US claimed
US-10472332-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2019-11-12 — — US claimed
EP-2826770-B1 ACYLGUANIDINE COMPOUNDS WITH ANTIVIRAL ACTIVITY BIOTRON LTD (AU) 2018-09-12 — — EP claimed
US-20170260147-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2017-09-14 — — US claimed
US-20160376231-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2016-12-29 — — US claimed
US-20150313909-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2015-11-05 — — US claimed
EP-2826770-A1 Acylguanidine compounds with antiviral activity Biotron Limited (AU) 2015-01-21 — — EP claimed
CN-103274970-A Antiviral compounds and methods BIOTRON LTD 2013-09-04 — — CN claimed
US-20100254942-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS BIOTRON LIMITED (AU) 2010-10-07 — — US claimed
CN-101827589-A Hepatitis c antiviral compositions and methods BIOTROM LTD 2010-09-08 — — CN claimed
US-20090099239-A1 Antiviral Compounds and Methods BIOTRON LIMITED (AU) 2009-04-16 — — US claimed
JP-2008543886-A — — 2008-12-04 — — JP claimed
CN-101208297-A Antiviral compounds and methods BIOTRON LTD (AU) 2008-06-25 — — CN claimed
EP-1902017-A1 ANTIVIRAL COMPOUNDS AND METHODS Biotron Limited (AU) 2008-03-26 — — EP claimed
US-20070099968-A1 Antiviral compounds and methods BIOTRON LIMITED (AU) 2007-05-03 — — US claimed
WO-2006135978-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2006-12-28 — — WO claimed
EP-1646371-A2 ANTIVIRAL COMPOUNDS AND METHODS Biotron Limited (AU) 2006-04-19 — — EP claimed
WO-2004112687-A2 ANTIVIRAL ACYLGUANIDINE COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2004-12-29 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (9 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-20100254942-A1 HEPATITIS C ANTIVIRAL COMPOSITIONS AND METHODS HAVCR2, HCCS, EIF2AK2 CYP1A2 2401/4885MAPT 4416/4885NPC1 560/4885
US-11192863-B2 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3645/4885MAPT 3427/4885NPC1 290/4885
US-10683263-B2 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3983/4885MAPT 4471/4885NPC1 333/4885
US-10472332-B2 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3645/4885MAPT 3427/4885NPC1 290/4885
US-20070099968-A1 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3324/4885MAPT 3545/4885NPC1 361/4885
US-20170260147-A1 ANTIVIRAL COMPOUNDS AND METHODS MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3645/4885MAPT 3427/4885NPC1 290/4885
US-20090099239-A1 Antiviral Compounds and Methods MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3983/4885MAPT 4471/4885NPC1 333/4885
US-20150313909-A1 ANTIVIRAL COMPOUNDS AND METHODS ZC3HAV1, MAVS, EIF2AK2 CYP1A2 3795/4885MAPT 3702/4885NPC1 340/4885
US-20160376231-A1 ANTIVIRAL COMPOUNDS AND METHODS MAVS, ZC3HAV1, EIF2AK2 CYP1A2 3983/4885MAPT 4471/4885NPC1 333/4885

“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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