SCHEMBL3387002

SCHEMBL3387002

CCN1CCN(c2cc(C(=O)Nc3ccc(C)c(NC(=O)N(C)c4ncnc5[nH]ccc45)c3)cc(C(F)(F)F)c2)CC1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LYN P07948 2/20 0.55
INSR P06213 1/20 0.55
LCK P06239 1/20 0.55
HCK P08631 1/20 0.55
SRC P12931 1/20 0.55
KDR P35968 1/20 0.55
BRAF P15056 11/20 0.53
RAF1 P04049 6/20 0.53
MAP3K7 O43318 2/20 0.51
MAP4K2 Q12851 2/20 0.51
CSF1R P07333 6/20 0.49
MAPK14 Q16539 1/20 0.49
DDR1 Q08345 1/20 0.46

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
SCHEMBL3387657 0.93 MAP3K7 (0.51) LYNINSRLCKHCKSRC
SCHEMBL3387035 0.92 MAP3K7 (0.59) LYNINSRLCKHCKSRC
SCHEMBL3387007 0.91 MAP3K7 (0.51) LYNINSRLCKHCKSRC
SCHEMBL3390724 0.90 CSF1R (0.60) LYNBRAFRAF1MAP3K7MAP4K2
SCHEMBL3386965 0.86 BRAF (0.60) LYNHCKSRCBRAFRAF1
SCHEMBL3388334 0.85 CSF1R (0.60) LYNINSRLCKHCKSRC
SCHEMBL3388557 0.84 MAPK14 (0.68) LYNSRCRAF1MAP3K7MAP4K2
SCHEMBL3391195 0.83 BRAF (0.49) LCKKDRBRAFRAF1CSF1R
SCHEMBL3388452 0.82 MAP3K7 (0.70) LYNSRCBRAFRAF1MAP3K7
SCHEMBL3386984 0.82 CSF1R (0.58) LCKKDRBRAFRAF1CSF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US claimed
EP-1891066-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-12-22 EP claimed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US claimed
EP-1891066-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-02-27 EP claimed
WO-2006124462-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2006-11-23 WO claimed
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US disclosed
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US disclosed
US-8183248-B2 Substituted pyrrolo[2,3-d]pyrimidines and compositions as protein kinase inhibitors IRM LLC (BM) 2012-05-22 US disclosed
EP-1891066-B1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2010-12-22 EP disclosed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US disclosed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US disclosed
US-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2009-05-07 US disclosed
EP-1891066-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2008-02-27 EP disclosed
WO-2006124462-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM, LLC (BM) 2006-11-23 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-20090118273-A1 Compounds and Compositions as Protein Kinase Inhibitors SRC, FYN, SYK LYN 32/4885INSR 1893/4885LCK 30/4885

“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.