SCHEMBL5069172

SCHEMBL5069172

CCn1c(/C(C#N)=N/O)nc2c(Cl)nc(Cl)cc21

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
POLB P06746 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
TP53 P04637 2/20 0.34
MAPT P10636 1/20 0.34
HSD17B10 Q99714 2/20 0.31
KDM4E B2RXH2 1/20 0.31
KMT2A Q03164 1/20 0.31
CNR2 P34972 1/20 0.30

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
SCHEMBL4595462 1.00 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL5065108 0.88 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL5065109 0.88 ALDH1A1 (0.54) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL691440 0.73 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL691439 0.73 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL5062800 0.65 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL5062797 0.65 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL4595536 0.61 RPS6KA5 (0.69)
SCHEMBL5597279 0.61 ALDH1A1 (0.34) SMN1; SMN2ALDH1A1HPGDPOLBL3MBTL1
SCHEMBL4596427 0.60 RORC (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 US disclosed
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 US disclosed
US-20080318947-A1 Inhibitors of Akt Activity HEERDING DIRK A 2008-12-25 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-20080318947-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 SMN1; SMN2 3299/4885ALDH1A1 4166/4885HPGD 3723/4885

“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.