SCHEMBL5443375

SCHEMBL5443375

NC(N)=NC(=O)/C=C/c1ccc(F)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 1/20 0.58
▸ TNFRSF1A P19438 1/20 0.53
▸ HTR2B P41595 1/20 0.48
▸ TRPA1 O75762 2/20 0.47
▸ GRIN1 Q05586 3/20 0.45
▸ GRIN2B Q13224 3/20 0.45
▸ LMNA P02545 4/20 0.45
▸ TP53 P04637 3/20 0.45
▸ MAOA P21397 3/20 0.45
▸ MAOB P27338 3/20 0.45
▸ ALDH1A1 P00352 2/20 0.45
▸ SLC5A1 P13866 1/20 0.45
▸ SLC5A2 P31639 1/20 0.45
▸ GRIN2D O15399 2/20 0.44
▸ GRIN3B O60391 2/20 0.44
▸ GRIN2A Q12879 2/20 0.44
▸ GRIN2C Q14957 2/20 0.44
▸ GRIN3A Q8TCU5 2/20 0.44
▸ CYP1A1 P04798 1/20 0.44
▸ CYP1B1 Q16678 1/20 0.44

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
SCHEMBL5432585 0.84 TYR (0.57) HSD11B1HTR2BLMNAMAOBMMP1
SCHEMBL5436045 0.82 MAPT (0.53) HTR2BGRIN1GRIN2BLMNAMAOA
SCHEMBL5426867 0.82 HTR2B (0.48) HTR2BLMNAMAOAMAOBALDH1A1
SCHEMBL5425527 0.82 CYP1A2 (0.58) HTR2BGRIN1GRIN2BLMNAMAOA
SCHEMBL1949536 0.81 MAPT (0.55) TNFRSF1AHTR2BGRIN1GRIN2BLMNA
SCHEMBL5433146 0.81 HTR2B (0.54) HSD11B1HTR2BGRIN1GRIN2BCYP1A1
SCHEMBL5432257 0.81 CYP1A2 (0.62) HTR2BGRIN1GRIN2BMAOAMAOB
SCHEMBL5441731 0.80 NFE2L2 (0.52) HTR2BMAOAMAOBALDH1A1CYP1A1
Hydrochloric Acid SCHEMBL5427451 0.80 HTR2B (0.56) TNFRSF1AHTR2BGRIN1GRIN2BLMNA
SCHEMBL5431012 0.79 HDAC2 (0.56) HTR2BLMNATP53ALDH1A1MAPT

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 16 patents. 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-10472332-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2019-11-12 — — US claimed
US-20170260147-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2017-09-14 — — US claimed
US-20150313909-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2015-11-05 — — US claimed
US-20130035328-A1 ANTIVIRAL COMPOUNDS AND METHODS GAGE PETER WILLIAM (AU) 2013-02-07 — — US claimed
US-20070099968-A1 Antiviral compounds and methods BIOTRON LIMITED (AU) 2007-05-03 — — US 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
EP-2617709-B1 Guanidine derivatives as antiviral agents BIOTRON LTD (AU) 2022-11-16 — — EP disclosed
US-11192863-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2021-12-07 — — US disclosed
US-10472332-B2 Antiviral compounds and methods BIOTRON LIMITED (AU) 2019-11-12 — — US disclosed
US-20170260147-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2017-09-14 — — US disclosed
US-20150313909-A1 ANTIVIRAL COMPOUNDS AND METHODS BIOTRON LIMITED (AU) 2015-11-05 — — US disclosed
EP-2617709-A1 Guanidine derivatives as antiviral agents Biotron Limited (AU) 2013-07-24 — — EP disclosed
US-20130035328-A1 ANTIVIRAL COMPOUNDS AND METHODS GAGE PETER WILLIAM (AU) 2013-02-07 — — US disclosed
US-20070099968-A1 Antiviral compounds and methods BIOTRON LIMITED (AU) 2007-05-03 — — 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 (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-11192863-B2 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 HSD11B1 2826/4885TNFRSF1A 3672/4885HTR2B 4140/4885
US-10472332-B2 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 HSD11B1 2826/4885TNFRSF1A 3672/4885HTR2B 4140/4885
US-20070099968-A1 Antiviral compounds and methods MAVS, ZC3HAV1, EIF2AK2 HSD11B1 2483/4885TNFRSF1A 3646/4885HTR2B 4329/4885
US-20170260147-A1 ANTIVIRAL COMPOUNDS AND METHODS MAVS, ZC3HAV1, EIF2AK2 HSD11B1 2826/4885TNFRSF1A 3672/4885HTR2B 4140/4885
US-20130035328-A1 ANTIVIRAL COMPOUNDS AND METHODS ZC3HAV1, MAVS, EIF2AK2 HSD11B1 2829/4885TNFRSF1A 3643/4885HTR2B 4247/4885
US-20150313909-A1 ANTIVIRAL COMPOUNDS AND METHODS ZC3HAV1, MAVS, EIF2AK2 HSD11B1 2829/4885TNFRSF1A 3643/4885HTR2B 4247/4885

“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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