SCHEMBL5841298

SCHEMBL5841298

Cc1cc(C)nc(C(C)Nc2ccc(NC(=O)C3CC(=O)N(c4ccccc4C(C)C)C3)cc2)n1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.53
MAPT P10636 1/20 0.52
ALDH1A1 P00352 6/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
NPSR1 Q6W5P4 1/20 0.49
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA4 P22748 1/20 0.46
CA6 P23280 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA13 Q8N1Q1 1/20 0.46
CA5B Q9Y2D0 1/20 0.46
POLB P06746 2/20 0.45
TP53 P04637 2/20 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
SCHEMBL5842322 0.87 ALDH1A1 (0.57) ALOX15MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL5843928 0.87 ALDH1A1 (0.67) MAPTALDH1A1MEN1KMT2ACA12
SCHEMBL5841634 0.85 ALDH1A1 (0.55) ALOX15MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL5841403 0.85 MAPT (0.51) MAPTALDH1A1SMN1; SMN2NPSR1TP53
SCHEMBL5841640 0.84 ALOX15 (0.52) ALOX15MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL5841293 0.83 ALDH1A1 (0.53) ALOX15MAPTALDH1A1SMN1; SMN2NPSR1
SCHEMBL5844459 0.83 TP53 (0.63) ALDH1A1SMN1; SMN2MEN1KMT2APOLB
SCHEMBL5843662 0.83 ALDH1A1 (0.56) MAPTALDH1A1SMN1; SMN2NPSR1MEN1
SCHEMBL5843008 0.82 SMN1; SMN2 (0.52) MAPTALDH1A1SMN1; SMN2NPSR1KMT2A
SCHEMBL5841284 0.82 ALDH1A1 (0.50) ALOX15MAPTALDH1A1SMN1; SMN2NPSR1

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 ALOX15 902/4885MAPT 4395/4885ALDH1A1 3034/4885

“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.