SCHEMBL3280654

SCHEMBL3280654

c1cc2c(Nc3ccc4[nH]ncc4c3)nc(Nc3ccc(N4CCNCC4)cc3)nc2[nH]1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.62
PTK2 Q05397 5/20 0.59
PDGFRA P16234 4/20 0.58
PDGFRB P09619 2/20 0.58
ROCK1 Q13464 7/20 0.55
WEE1 P30291 5/20 0.55
ALK Q9UM73 5/20 0.55
JAK2 O60674 4/20 0.55
AURKA O14965 3/20 0.55
DAPK3 O43293 3/20 0.55
PRKD3 O94806 3/20 0.55
MAP4K4 O95819 3/20 0.55
PAK4 O96013 3/20 0.55
LCK P06239 3/20 0.55
FYN P06241 3/20 0.55
CSF1R P07333 3/20 0.55
RET P07949 3/20 0.55
IGF1R P08069 3/20 0.55
FGFR1 P11362 3/20 0.55
PRKACA P17612 3/20 0.55

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
SCHEMBL3283903 0.93 PDGFRA (0.68) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL3281334 0.86 EGFR (0.61) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL4198251 0.86 EGFR (0.59) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL3280136 0.82 EGFR (0.71) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL3279981 0.81 PDGFRB (0.56) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL3283451 0.81 PTK2 (0.57) EGFRPTK2PDGFRAPDGFRBJAK2
SCHEMBL13406069 0.80 PDGFRA (0.57) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL3280599 0.80 PTK2 (0.57) EGFRPTK2PDGFRAPDGFRBJAK2
SCHEMBL3279455 0.79 EGFR (0.57) EGFRPTK2PDGFRAPDGFRBROCK1
SCHEMBL3286821 0.79 SYK (0.69) EGFRPTK2PDGFRAPDGFRBALK

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-7705004-B2 Protein kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-04-27 US claimed
WO-2009026107-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 WO claimed
US-20090054425-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 US claimed
US-7705004-B2 Protein kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-04-27 US disclosed
US-7705004-B2 Protein kinase inhibitors PORTOLA PHARMACEUTICALS, INC. (US) 2010-04-27 US disclosed
WO-2009026107-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 WO disclosed
US-20090054425-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 US disclosed
US-20090054425-A1 PROTEIN KINASE INHIBITORS PORTOLA PHARMACEUTICALS, INC. (US) 2009-02-26 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-20090054425-A1 PROTEIN KINASE INHIBITORS SYK, JAK2, BTK EGFR 639/4885PTK2 196/4885PDGFRA 454/4885

“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.