SCHEMBL5843016

SCHEMBL5843016

CCOC(=O)CCCCN(c1ccccc1)c1ccc(NC(=O)C2CC(=O)N(C3Cc4ccccc4C3)C2)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
KMT2A Q03164 1/20 0.44
GHSR Q92847 1/20 0.40
POLB P06746 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
MCL1 Q07820 1/20 0.39
HIF1A Q16665 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL5841595 0.84 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5848025 0.83 ALOX15 (0.48) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5841812 0.83 MAPT (0.48) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5842485 0.81 MAPT (0.47) ALDH1A1SMN1; SMN2KMT2APOLBKDM4E
SCHEMBL5843024 0.80 KMT2A (0.46) ALDH1A1SMN1; SMN2L3MBTL1KMT2APOLB
SCHEMBL5842129 0.80 ALDH1A1 (0.53) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5841930 0.80 ALDH1A1 (0.57) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5842367 0.80 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5842752 0.79 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT
SCHEMBL5841897 0.77 ALDH1A1 (0.58) ALDH1A1SMN1; SMN2L3MBTL1LMNAHTT

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 disclosed
US-20050192292-A1 Pyrrolidone carboxamides ACTELION PHARMACEUTICALS AG (CH) 2005-09-01 US disclosed
EP-1463724-A1 PYRROLIDONE CARBOXAMIDES Actelion Pharmaceuticals Ltd. (CH) 2004-10-06 EP disclosed
WO-2003059905-A1 PYRROLIDONE CARBOXAMIDES ACTELION PHARMACEUTICALS LTD (CH) 2003-07-24 WO 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 3678/4885L3MBTL1 3047/4885

“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.