SCHEMBL12880536

SCHEMBL12880536

CN1CCN(C(=O)c2cc(F)ccc2Cc2cnc(-c3nc4ccc(N5CCOCC5)cn4c(=O)c3O)s2)CC1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MAPT P10636 2/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TP53 P04637 2/20 0.38
LMNA P02545 1/20 0.35
TTK P33981 1/20 0.35
PIK3CA P42336 4/20 0.34
CSNK1D P48730 2/20 0.34
CSNK1E P49674 2/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.34
STAT6 P42226 1/20 0.34
SLC2A1 P11166 1/20 0.33
PIK3CB P42338 1/20 0.33
ENPP2 Q13822 1/20 0.33
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33

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
SCHEMBL12894068 0.89 JAK2 (0.38) PIK3CACSNK1DCSNK1ESTAT6SLC2A1
SCHEMBL12880546 0.89 MEN1 (0.40) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL12880527 0.89 JAK2 (0.38) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL12880542 0.88 IDO1 (0.37) ALDH1A1SMN1; SMN2LMNAPIK3CACSNK1D
SCHEMBL14749134 0.88 CSNK1D (0.33) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL12880535 0.87 LMNA (0.40) KMT2AMAPTALDH1A1SMN1; SMN2LMNA
SCHEMBL12880534 0.85 ENPP2 (0.38) ALDH1A1SMN1; SMN2LMNAPIK3CACSNK1D
SCHEMBL1360732 0.84 ALDH1A1 (0.40) KMT2AMAPTMEN1ALDH1A1SMN1; SMN2
SCHEMBL12880529 0.84 PIK3CA (0.37) ALDH1A1SMN1; SMN2LMNAPIK3CACSNK1D
SCHEMBL13512869 0.83 SLC2A1 (0.33) ALDH1A1SMN1; SMN2LMNAPIK3CACSNK1D

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-2212324-B1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LTD (AU) 2014-03-26 EP claimed
EP-2759544-A1 Compounds having antiviral properties Avexa Limited (AU) 2014-07-30 EP disclosed
EP-2759544-A1 Compounds having antiviral properties Avexa Limited (AU) 2014-07-30 EP disclosed
EP-2212324-B1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LTD (AU) 2014-03-26 EP disclosed
EP-2212324-B1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LTD (AU) 2014-03-26 EP disclosed
US-8563562-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2013-10-22 US disclosed
US-8563562-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2013-10-22 US disclosed
US-8563562-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2013-10-22 US disclosed
US-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2013-03-07 US disclosed
US-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2013-03-07 US disclosed
US-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2013-03-07 US disclosed
US-8318732-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2012-11-27 US disclosed
US-8318732-B2 Compounds having antiviral properties AVEXA LIMITED (AU) 2012-11-27 US disclosed
US-20110039842-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2011-02-17 US disclosed
US-20110039842-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2011-02-17 US disclosed
WO-2010000032-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES AVEXA LIMITED (AU) 2010-01-07 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 (2 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-20110039842-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES ZC3HAV1, ACE, EIF2AK2 KMT2A 3774/4885MAPT 3349/4885MEN1 1800/4885
US-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES ZC3HAV1, ACE, EIF2AK2 KMT2A 3774/4885MAPT 3349/4885MEN1 1800/4885

“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.