SCHEMBL3949281

SCHEMBL3949281

NC(=O)CNC(=O)c1c[c]ccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SPHK2 Q9NRA0 1/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
HIF1A Q16665 1/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37
HPGDS O60760 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
THRB P10828 1/20 0.36
KDM1A O60341 1/20 0.36
F10 P00742 2/20 0.35
GPR139 Q6DWJ6 1/20 0.35
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL3313893 0.83 GAA (0.41) GAAMAPTSMN1; SMN2THRBKMT2A
SCHEMBL10716721 0.80 KDM4E (0.48) CA1CA2CA9GAAKDM4E
SCHEMBL3316339 0.80 MAOB (0.51) SPHK2GAAKDM4ESMN1; SMN2KMT2A
SCHEMBL158021 0.79 GAA (0.41) CA12CA9GAAKDM4EMAPT
SCHEMBL3191593 0.79 CA1 (0.47) SPHK2CA1CA2CA12CA9
SCHEMBL28980936 0.79 ALDH1A1 (0.50) GAAKDM4EMAPTSMN1; SMN2GPR139
SCHEMBL3090568 0.78 GAA (0.63) SPHK2CA1CA2CA12CA9
SCHEMBL1415854 0.78 POLB (0.46) SPHK2CA1CA2CA12CA9
SCHEMBL6963777 0.77 CTSL (0.43) GAA
SCHEMBL1490709 0.77 L3MBTL1 (0.55) GAAKDM4ESMN1; SMN2KMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090048269-A1 CHEMICAL COMPOUNDS-821 ASTRAZENECA AB (SE) 2009-02-19 US disclosed
WO-2009022171-A1 PYRIDINYIIOXY PYRIDINES AS ALK5 INHIBITORS ASTRAZENECA AB (SE) 2009-02-19 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 (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-20090048269-A1 CHEMICAL COMPOUNDS-821 TGFBR1, TGFBR2, SMAD3 SPHK2 1483/4885CA1 870/4885CA2 427/4885

“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.