SCHEMBL5842446

SCHEMBL5842446

COc1ccc(C)c(N2CC(C(=O)Nc3ccc(Nc4ccccc4Cc4ccccc4)cc3)CC2=O)c1

nearest known ligand 0.58

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.53
POLB P06746 4/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TSHR P16473 1/20 0.49
ALDH1A1 P00352 4/20 0.48
NPSR1 Q6W5P4 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
LMNA P02545 1/20 0.46

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) MAPTPOLBTSHRALDH1A1NPSR1
SCHEMBL5844102 0.91 MAPT (0.55) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL5842252 0.90 MAPT (0.60) MAPTPOLBTSHRALDH1A1NPSR1
SCHEMBL5841318 0.89 MAPT (0.51) MAPTPOLBMEN1KMT2ATSHR
SCHEMBL5842932 0.87 MAPT (0.60) MAPTPOLBKMT2ATSHRALDH1A1
SCHEMBL5844337 0.84 MAPT (0.53) MAPTPOLBTSHRALDH1A1NPSR1
SCHEMBL5842613 0.82 MAPT (0.56) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL5842434 0.82 MAPT (0.52) MAPTPOLBTSHRALDH1A1NPSR1
SCHEMBL5841925 0.81 ALOX15 (0.55) MAPTPOLBMEN1KMT2AALDH1A1
SCHEMBL5842233 0.80 MAPT (0.56) MAPTPOLBKMT2ATSHRALDH1A1

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 MAPT 4395/4885POLB 4023/4885MEN1 3619/4885

“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.