SCHEMBL5842457

SCHEMBL5842457

CC(=O)c1ccc(NC(=O)C2CC(=O)N(c3cc(C)ccc3C)C2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.60
MAPT P10636 4/20 0.59
LMNA P02545 2/20 0.58
NPSR1 Q6W5P4 2/20 0.58
SMN1; SMN2 Q16637 6/20 0.54
KDM4E B2RXH2 1/20 0.53
HPGD P15428 1/20 0.53
MCL1 Q07820 1/20 0.53
HIF1A Q16665 1/20 0.53
NPC1 O15118 1/20 0.53
GLA P06280 1/20 0.53
RAB9A P51151 1/20 0.53
POLB P06746 1/20 0.52
TP53 P04637 1/20 0.51
THRB P10828 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
SCHEMBL5841451 0.91 ALDH1A1 (0.69) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5843367 0.90 MAPT (0.62) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5842097 0.89 MAPT (0.61) ALDH1A1MAPTLMNANPSR1SMN1; SMN2
SCHEMBL5841854 0.86 MAPT (0.61) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5841187 0.86 SMN1; SMN2 (0.59) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5842030 0.86 MAPT (0.64) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5842505 0.86 MAPT (0.64) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5842617 0.86 MAPT (0.58) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5844411 0.86 ALDH1A1 (0.72) ALDH1A1MAPTNPSR1SMN1; SMN2KDM4E
SCHEMBL5841070 0.85 MAPT (0.56) ALDH1A1MAPTNPSR1SMN1; SMN2NPC1

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 ALDH1A1 3034/4885MAPT 4395/4885LMNA 3430/4885

“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.