SCHEMBL14749134

SCHEMBL14749134

O=C(c1cc(F)ccc1Cc1cnc(-c2nc3ccc(N4CCOCC4)cn3c(=O)c2O)s1)N1CCCS1(=O)=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 2/20 0.33
CSNK1E P49674 2/20 0.33
STAT6 P42226 2/20 0.33
SLC2A1 P11166 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
LRRK2 Q5S007 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31

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
SCHEMBL14749179 0.90 MEN1 (0.33) STAT6SMN1; SMN2ALDH1A1MEN1MAPT
SCHEMBL12880536 0.88 KMT2A (0.38) CSNK1DCSNK1ESTAT6SLC2A1SMN1; SMN2
SCHEMBL12880532 0.87 SLC2A1 (0.33) CSNK1DCSNK1ESTAT6SLC2A1SMN1; SMN2
SCHEMBL12880531 0.86 SLC2A1 (0.34) CSNK1DCSNK1ESTAT6SLC2A1SMN1; SMN2
SCHEMBL12894068 0.85 JAK2 (0.38) CSNK1DCSNK1ESTAT6SLC2A1PIK3CA
SCHEMBL12880527 0.85 JAK2 (0.38) CSNK1DCSNK1ESTAT6SLC2A1SMN1; SMN2
SCHEMBL12880542 0.82 IDO1 (0.37) CSNK1DCSNK1ESLC2A1SMN1; SMN2ALDH1A1
SCHEMBL12880534 0.81 ENPP2 (0.38) CSNK1DCSNK1ESTAT6SLC2A1SMN1; SMN2
SCHEMBL13512869 0.81 SLC2A1 (0.33) CSNK1DCSNK1ESTAT6SLC2A1SMN1; SMN2
SCHEMBL12880535 0.81 LMNA (0.40) CSNK1DCSNK1ESLC2A1SMN1; SMN2ALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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

For each of this compound's patents that has machine-readable text (1 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-20130059865-A1 COMPOUNDS HAVING ANTIVIRAL PROPERTIES ZC3HAV1, ACE, EIF2AK2 CSNK1D 889/4885CSNK1E 719/4885STAT6 845/4885

“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.