SCHEMBL4586876

SCHEMBL4586876

Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccn4-c4ncnc5[nH]ccc45)c3)cc(C(F)(F)F)c2)cn1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K2 Q12851 2/20 0.62
MAP3K7 O43318 1/20 0.62
HCK P08631 3/20 0.58
KDR P35968 2/20 0.58
LCK P06239 2/20 0.58
LYN P07948 2/20 0.58
SRC P12931 2/20 0.58
INSR P06213 1/20 0.58
EPHB2 P29323 2/20 0.58
ABL1 P00519 8/20 0.57
LDLR P01130 3/20 0.57
KIT P10721 3/20 0.57
PCSK9 Q8NBP7 3/20 0.57
PDGFRB P09619 2/20 0.57
MAPK14 Q16539 2/20 0.56
MAP3K20 Q9NYL2 2/20 0.56
RAF1 P04049 2/20 0.56
BCR P11274 5/20 0.55
ADORA3 P0DMS8 2/20 0.55
NR1I2 O75469 1/20 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
SCHEMBL4587496 0.92 CSF1R (0.56) MAP4K2MAP3K7HCKKDRLCK
SCHEMBL4588492 0.90 ABL1 (0.58) MAP4K2HCKKDRLCKLYN
SCHEMBL14097647 0.89 MAP3K7 (0.48) MAP4K2MAP3K7HCKKDRLCK
SCHEMBL4587278 0.89 KDR (0.58) MAP4K2HCKKDRLCKLYN
SCHEMBL14097645 0.82 KDM4E (0.43) MAP4K2MAP3K7HCKKDRLCK
SCHEMBL4586222 0.82 PIKFYVE (0.57) HCKKDRLCKLYNSRC
SCHEMBL13269734 0.81 SRC (0.58) MAP4K2HCKKDRLCKLYN
SCHEMBL3386095 0.81 MAP4K2 (0.63) MAP4K2MAP3K7HCKKDRLCK
SCHEMBL20502614 0.79 ABL1 (0.81) HCKKDRLCKLYNSRC
SCHEMBL4587765 0.79 BRAF (0.53) MAP4K2MAP3K7KDRLCKLYN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080188483-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-08-07 US claimed
US-20080188483-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-08-07 US disclosed
US-20080188483-A1 Compounds and Compositions as Protein Kinase Inhibitors IRM LLC (BM) 2008-08-07 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-20080188483-A1 Compounds and Compositions as Protein Kinase Inhibitors SRC, SGK2, PTK2B MAP4K2 14/4885MAP3K7 41/4885HCK 113/4885

“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.