SCHEMBL5842252

SCHEMBL5842252

COc1ccc(C)c(N2CC(C(=O)Nc3ccc(Nc4ccccc4C)cc3)CC2=O)c1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.60
ALDH1A1 P00352 6/20 0.54
NPSR1 Q6W5P4 2/20 0.54
TSHR P16473 1/20 0.53
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
POLB P06746 1/20 0.51
GAA P10253 3/20 0.50
USP2 O75604 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GFER P55789 1/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL5842932 0.91 MAPT (0.60) MAPTALDH1A1NPSR1TSHRSMN1; SMN2
SCHEMBL5842420 0.91 MAPT (0.54) MAPTALDH1A1NPSR1TSHRLMNA
SCHEMBL5844337 0.90 MAPT (0.53) MAPTALDH1A1NPSR1TSHRLMNA
SCHEMBL5842446 0.90 MAPT (0.53) MAPTALDH1A1NPSR1TSHRLMNA
SCHEMBL5843721 0.89 MAPT (0.63) MAPTALDH1A1NPSR1SMN1; SMN2GAA
SCHEMBL5841318 0.88 MAPT (0.51) MAPTALDH1A1NPSR1TSHRLMNA
SCHEMBL5841187 0.84 SMN1; SMN2 (0.59) MAPTALDH1A1NPSR1SMN1; SMN2GAA
SCHEMBL5842233 0.84 MAPT (0.56) MAPTALDH1A1NPSR1TSHRSMN1; SMN2
SCHEMBL5842706 0.84 ALDH1A1 (0.53) MAPTALDH1A1NPSR1SMN1; SMN2POLB
SCHEMBL5841226 0.82 MAPT (0.50) MAPTALDH1A1NPSR1TSHRLMNA

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 4395/4885ALDH1A1 3034/4885NPSR1 24/4885

“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.