SCHEMBL5841318

SCHEMBL5841318

COc1ccc(C)c(N2CC(C(=O)Nc3ccc(Nc4ccccc4CC4CC4)cc3)CC2=O)c1

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
POLB P06746 2/20 0.47
TSHR P16473 1/20 0.47
LMNA P02545 1/20 0.46
ALDH1A1 P00352 6/20 0.46
NPSR1 Q6W5P4 2/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
GAA P10253 2/20 0.45
USP2 O75604 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL5842420 0.92 MAPT (0.54) MAPTPOLBTSHRLMNAALDH1A1
SCHEMBL5841856 0.91 MAPT (0.53) MAPTALDH1A1NPSR1SMN1; SMN2GAA
SCHEMBL5842446 0.89 MAPT (0.53) MAPTPOLBTSHRLMNAALDH1A1
SCHEMBL5842252 0.88 MAPT (0.60) MAPTPOLBTSHRLMNAALDH1A1
SCHEMBL5842932 0.85 MAPT (0.60) MAPTPOLBTSHRALDH1A1NPSR1
SCHEMBL5844337 0.84 MAPT (0.53) MAPTPOLBTSHRLMNAALDH1A1
SCHEMBL5842613 0.82 MAPT (0.56) MAPTPOLBALDH1A1NPSR1SMN1; SMN2
SCHEMBL5841312 0.82 MAPT (0.52) MAPTPOLBTSHRALDH1A1NPSR1
SCHEMBL5841845 0.81 MEN1 (0.53) MAPTPOLBALDH1A1NPSR1SMN1; SMN2
SCHEMBL5844102 0.79 MAPT (0.55) MAPTPOLBALDH1A1NPSR1SMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 MAPT 4395/4885POLB 4023/4885TSHR 79/4885

“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.