SCHEMBL5842594

SCHEMBL5842594

O=C(Nc1ccc(Nc2ccccc2)cc1)C1CC(=O)N(C2CCCCCC2)C1

nearest known ligand 0.91

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.91
SMN1; SMN2 Q16637 1/20 0.91

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
SCHEMBL5843404 0.87 ALDH1A1 (0.68) ALDH1A1SMN1; SMN2
SCHEMBL5843692 0.82 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2
SCHEMBL6613932 0.81 ALDH1A1 (0.60) ALDH1A1SMN1; SMN2
SCHEMBL5843116 0.80 CA12 (0.72) ALDH1A1
SCHEMBL8020692 0.79 HPGD (0.87) ALDH1A1SMN1; SMN2
SCHEMBL21067765 0.78 ALDH1A1 (0.70) ALDH1A1SMN1; SMN2
SCHEMBL5843795 0.77 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2
SCHEMBL2185266 0.76 ALDH1A1 (0.63) ALDH1A1SMN1; SMN2
SCHEMBL5841693 0.76 ALDH1A1 (0.61) ALDH1A1SMN1; SMN2
SCHEMBL5841136 0.75 TP53 (0.68) ALDH1A1SMN1; SMN2

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-7067549-B2 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2006-06-27 US disclosed
US-20050192292-A1 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2005-09-01 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-20050192292-A1 Pyrrolidone carboxamides NPY1R, NPY5R, NPY2R ALDH1A1 3034/4885SMN1; SMN2 3678/4885

“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.