SCHEMBL5842685

SCHEMBL5842685

Cc1cc(C)nc(CNc2ccc(NC(=O)C3CC(=O)N(CCc4ccccc4)C3)cc2)n1

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.59
LMNA P02545 3/20 0.57
ALDH1A1 P00352 5/20 0.54
POLB P06746 3/20 0.54
TP53 P04637 1/20 0.54
NPC1 O15118 1/20 0.52
GLA P06280 1/20 0.52
MAPT P10636 1/20 0.52
RAB9A P51151 1/20 0.52
HPGD P15428 1/20 0.52
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GFER P55789 1/20 0.50
KDM4E B2RXH2 1/20 0.50
RXFP3 Q9NSD7 3/20 0.49

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
SCHEMBL5842777 0.92 LMNA (0.61) SMN1; SMN2LMNAALDH1A1POLBTP53
SCHEMBL5841224 0.91 ALDH1A1 (0.67) SMN1; SMN2LMNAALDH1A1NPC1GLA
SCHEMBL5841926 0.89 ALDH1A1 (0.48) SMN1; SMN2LMNAALDH1A1NPC1GLA
SCHEMBL5842122 0.87 SMN1; SMN2 (0.61) SMN1; SMN2LMNAALDH1A1POLBTP53
SCHEMBL5842936 0.86 RXFP3 (0.53) SMN1; SMN2LMNAALDH1A1POLBMAPT
SCHEMBL5841921 0.85 ALDH1A1 (0.51) SMN1; SMN2LMNAALDH1A1NPC1GLA
SCHEMBL5842780 0.84 SMN1; SMN2 (0.57) SMN1; SMN2LMNAALDH1A1POLBTP53
SCHEMBL5842690 0.84 SMN1; SMN2 (0.57) SMN1; SMN2LMNAALDH1A1POLBTP53
SCHEMBL5843922 0.84 ALDH1A1 (0.64) SMN1; SMN2LMNAALDH1A1NPC1GLA
SCHEMBL5844738 0.83 ALDH1A1 (0.73) LMNAALDH1A1POLBTP53MAPT

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 SMN1; SMN2 3678/4885LMNA 3430/4885ALDH1A1 3034/4885

“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.