SCHEMBL4927129

SCHEMBL4927129

CCN(CC)C1CCN(c2ccc(-n3ncc4c(Nc5c(C)cccc5C)ncnc43)cc2)CC1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TP53 P04637 13/20 0.52
MAPT P10636 6/20 0.52
LMNA P02545 7/20 0.51
HSD17B10 Q99714 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 3/20 0.50
RAB9A P51151 3/20 0.50
TSHR P16473 2/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 2/20 0.46
HPGD P15428 2/20 0.45
NFKB1 P19838 1/20 0.44
MAPK1 P28482 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
NPSR1 Q6W5P4 1/20 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
SCHEMBL4920594 0.94 TP53 (0.51) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4920724 0.91 LMNA (0.64) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4917116 0.90 LMNA (0.49) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4923750 0.86 TP53 (0.52) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4923741 0.86 TP53 (0.52) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4916742 0.85 LMNA (0.63) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4927701 0.85 MAPT (0.55) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4917035 0.84 LMNA (0.49) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4925146 0.84 LMNA (0.54) TP53MAPTLMNAHSD17B10SMN1; SMN2
SCHEMBL4925964 0.84 LMNA (0.61) TP53MAPTLMNAHSD17B10SMN1; SMN2

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-20080096868-A1 1,4 Substituted Pyrazolopyrimidines as Kinase Inhibitors NOVARTIS AG (CH) 2008-04-24 US claimed
US-20080096868-A1 1,4 Substituted Pyrazolopyrimidines as Kinase Inhibitors NOVARTIS AG (CH) 2008-04-24 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-20080096868-A1 1,4 Substituted Pyrazolopyrimidines as Kinase Inhibitors MAP3K1, MAP4K2, MAP4K5 TP53 849/4885MAPT 1638/4885LMNA 3959/4885

“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.