SCHEMBL2969080

SCHEMBL2969080

CSC(=Nc1ccc(Cl)nc1)NC#N

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.51
ADRA2A P08913 2/20 0.47
ADRA2B P18089 2/20 0.47
ADRA2C P18825 2/20 0.47
ALDH1A1 P00352 4/20 0.42
DGAT1 O75907 1/20 0.38
KMT2A Q03164 3/20 0.35
MEN1 O00255 2/20 0.35
MAPT P10636 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
USP2 O75604 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
KCNJ11 Q14654 5/20 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
SCHEMBL8772859 0.80 ALDH1A1 (0.58) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL11072219 0.78 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL11072217 0.78 SMN1; SMN2 (0.46) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL16459527 0.77 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL15545332 0.77 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL9134643 0.77 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1DGAT1MAPTCYP1A2
SCHEMBL11168013 0.75 SMN1; SMN2 (0.59) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL10452572 0.75 SMN1; SMN2 (0.72) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL5530561 0.75 ADRA2A (0.53) ADRA2AADRA2BADRA2CALDH1A1KMT2A
SCHEMBL10341394 0.74 SMN1; SMN2 (0.57) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT

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-7763640-B2 Substituted oxyguanidines BAYER CORPSCIENCE AG (DE) 2010-07-27 US disclosed
US-20080312297-A1 Substituted Oxyguanidines BAYER CROPSCIENCE AG (DE) 2008-12-18 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-20080312297-A1 Substituted Oxyguanidines OGA, CAT, OGG1 SMN1; SMN2 678/4885ADRA2A 153/4885ADRA2B 263/4885

“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.