SCHEMBL5842472

SCHEMBL5842472

CCn1c2ccccc2c2cc(NC(=O)C3CC(=O)N(CCc4ccccc4)C3)ccc21

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.61
LMNA P02545 4/20 0.54
NPY5R Q15761 2/20 0.53
NPSR1 Q6W5P4 1/20 0.53
ALDH1A1 P00352 2/20 0.52
HPGD P15428 1/20 0.52
MEN1 O00255 4/20 0.52
KMT2A Q03164 4/20 0.52
KDM4E B2RXH2 2/20 0.52
POLB P06746 2/20 0.52
TP53 P04637 1/20 0.52
USP2 O75604 1/20 0.52
MAPT P10636 2/20 0.51
RORC P51449 1/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GFER P55789 1/20 0.50

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
SCHEMBL5842282 0.91 ALDH1A1 (0.64) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL5842182 0.87 NPSR1 (0.48) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL5842051 0.87 MAPT (0.56) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL5842710 0.85 RORC (0.53) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL6611567 0.85 NPY5R (0.51) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL5842084 0.85 NPY5R (0.66) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL5843034 0.85 ALDH1A1 (0.56) SMN1; SMN2LMNANPSR1ALDH1A1HPGD
SCHEMBL27599294 0.84 MEN1 (0.51) SMN1; SMN2LMNANPSR1ALDH1A1HPGD
SCHEMBL5842465 0.83 NPSR1 (0.56) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1
SCHEMBL5841477 0.83 NPSR1 (0.52) SMN1; SMN2LMNANPY5RNPSR1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067549-B2 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2006-06-27 US claimed
US-20050192292-A1 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2005-09-01 US claimed
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 3430/4885NPY5R 2/4885

“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.