SCHEMBL4467935

SCHEMBL4467935

CN1CCN(C(=O)c2ccc(-c3cc4c(N5CCN(C)CC5)ncnc4[nH]3)cc2)CC1

nearest known ligand 0.64

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 1/20 0.64
KIT P10721 14/20 0.61
PRMT5 O14744 2/20 0.58
ALK Q9UM73 1/20 0.56
BTK Q06187 1/20 0.56
TBK1 Q9UHD2 1/20 0.53

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
SCHEMBL13604150 0.87 RIPK1 (0.61) RIPK1KITALKBTKTBK1
SCHEMBL4065929 0.86 RIPK1 (0.60) RIPK1KITALKBTKTBK1
SCHEMBL4063817 0.85 RIPK1 (0.59) RIPK1KITALKBTKTBK1
SCHEMBL4473017 0.83 RIPK1 (0.57) RIPK1PRMT5ALKBTKTBK1
SCHEMBL4068131 0.83 RIPK1 (0.57) RIPK1ALKBTKTBK1
SCHEMBL4068055 0.82 RIPK1 (0.55) RIPK1KITALKBTKTBK1
SCHEMBL4068059 0.82 RIPK1 (0.55) RIPK1KITALKBTKTBK1
SCHEMBL24596889 0.81 RIPK1 (0.68) RIPK1ALKBTKTBK1
SCHEMBL4463465 0.80 RIPK1 (0.53) RIPK1KITALKBTKTBK1
SCHEMBL13604152 0.80 RIPK1 (0.53) RIPK1KITPRMT5ALKBTK

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7625894-B2 Pyrrolo[2,3-d]Pyrimidines as Protein Tyrosine Kinase Inhibitors NOVARTIS AG (CH) 2009-12-01 US claimed
US-20070135460-A1 7H-pyrrolopyrimidine derivatives CARAVATTI GIORGIO 2007-06-14 US claimed
EP-1718651-A2 7H-PYRROLOPYRIMIDINE DERIVATIVES Novartis AG (CH) 2006-11-08 EP claimed
WO-2005077951-A2 7H-PYRROLOPYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2005-08-25 WO claimed
US-7625894-B2 Pyrrolo[2,3-d]Pyrimidines as Protein Tyrosine Kinase Inhibitors NOVARTIS AG (CH) 2009-12-01 US disclosed
US-20070135460-A1 7H-pyrrolopyrimidine derivatives CARAVATTI GIORGIO 2007-06-14 US disclosed
EP-1718651-A2 7H-PYRROLOPYRIMIDINE DERIVATIVES Novartis AG (CH) 2006-11-08 EP disclosed
WO-2005077951-A2 7H-PYRROLOPYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2005-08-25 WO 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-20070135460-A1 7H-pyrrolopyrimidine derivatives DPYD, TYMP, DHPS RIPK1 3871/4885KIT 1776/4885PRMT5 531/4885

“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.