SCHEMBL5841502

SCHEMBL5841502

O=C(Nc1cccc(-c2ccccc2)c1)C1CC(=O)N(c2ccccc2)C1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.72
MEN1 O00255 5/20 0.64
KMT2A Q03164 5/20 0.64
MAPT P10636 2/20 0.64
GAA P10253 2/20 0.64
MAPK1 P28482 1/20 0.64
CA12 O43570 2/20 0.63
CA1 P00915 2/20 0.63
CA4 P22748 2/20 0.63
CA6 P23280 2/20 0.63
CA7 P43166 2/20 0.63
CA13 Q8N1Q1 2/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
CA5B Q9Y2D0 1/20 0.63
ALDH1A1 P00352 1/20 0.62
TDP1 Q9NUW8 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ROCK2 O75116 1/20 0.58
ROCK1 Q13464 1/20 0.58

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
SCHEMBL12310052 0.85 POLB (1.00) POLBMEN1KMT2AMAPTGAA
SCHEMBL5843116 0.85 CA12 (0.72) POLBMEN1KMT2AMAPTGAA
SCHEMBL5841097 0.82 ALDH1A1 (0.58) POLBMAPTCA12CA1CA4
SCHEMBL5843865 0.82 ALDH1A1 (0.62) POLBALDH1A1TDP1
SCHEMBL6614762 0.81 MGLL (0.60) POLBMEN1KMT2AMAPTGAA
SCHEMBL29709869 0.81 KMT2A (0.69) POLBMEN1KMT2AMAPTGAA
SCHEMBL12728561 0.80 ALDH1A1 (0.62) POLBMEN1KMT2AMAPTGAA
SCHEMBL5843822 0.79 CA12 (0.59) POLBMEN1KMT2AMAPTGAA
SCHEMBL5842380 0.79 CA12 (0.68) POLBMEN1KMT2AMAPTGAA
SCHEMBL21150842 0.79 CA12 (0.68) POLBMEN1KMT2AMAPTGAA

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 POLB 4023/4885MEN1 3619/4885KMT2A 3347/4885

“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.