SCHEMBL4921954

SCHEMBL4921954

Cc1ccccc1Nc1ncnc2c1cnn2-c1ccc(N2CCC(N(C)C)C2)cc1

nearest known ligand 0.65

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 9/20 0.65
LMNA P02545 6/20 0.65
TSHR P16473 2/20 0.64
HTT P42858 2/20 0.64
HSD17B10 Q99714 2/20 0.64
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
SMN1; SMN2 Q16637 1/20 0.64
MAPT P10636 7/20 0.55
MAPK14 Q16539 4/20 0.49
NPSR1 Q6W5P4 1/20 0.47
GAA P10253 1/20 0.45
MAPK1 P28482 1/20 0.45

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
SCHEMBL4926381 1.00 TP53 (0.65) TP53LMNATSHRHTTHSD17B10
SCHEMBL4921937 1.00 TP53 (0.65) TP53LMNATSHRHTTHSD17B10
SCHEMBL4923741 0.91 TP53 (0.52) TP53LMNATSHRHTTHSD17B10
SCHEMBL4923750 0.91 TP53 (0.52) TP53LMNATSHRHTTHSD17B10
SCHEMBL4921962 0.90 MAPT (0.52) TP53LMNATSHRHTTHSD17B10
SCHEMBL4921977 0.90 MAPT (0.52) TP53LMNATSHRHTTHSD17B10
SCHEMBL4927126 0.90 MAPT (0.52) TP53LMNATSHRHTTHSD17B10
SCHEMBL4925319 0.89 LMNA (0.62) TP53LMNATSHRHTTHSD17B10
SCHEMBL4917342 0.89 LMNA (0.55) TP53LMNATSHRHTTHSD17B10
SCHEMBL4917331 0.89 LMNA (0.55) TP53LMNATSHRHTTHSD17B10

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 849/4885LMNA 3959/4885TSHR 2609/4885

“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.