SCHEMBL4414025

SCHEMBL4414025

O=C(O)n1ccc2c(Nc3ccc(C(F)(F)F)cc3)ncnc21

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.51
ABL1 P00519 5/20 0.49
BCR P11274 5/20 0.49
EGFR P00533 1/20 0.47
KDR P35968 1/20 0.46
TTBK1 Q5TCY1 1/20 0.46
PIP4K2A P48426 1/20 0.45
PIK3CG P48736 1/20 0.45
CNR1 P21554 1/20 0.42
RET P07949 1/20 0.42
AURKA O14965 1/20 0.42
RPS6KB1 P23443 1/20 0.42
AURKB Q96GD4 1/20 0.42
EPHX2 P34913 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TRPV1 Q8NER1 3/20 0.41

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
SCHEMBL4416495 0.86 EGFR (0.57) EGFRKDRPIP4K2APIK3CGRET
SCHEMBL4414154 0.84 ABL1 (0.71) ABL1BCRTTBK1
SCHEMBL4412690 0.81 MKNK1 (0.49) ABL1BCREGFRTTBK1PIP4K2A
SCHEMBL4421383 0.77 RAB9A (0.57) FLT3ABL1EGFRPIP4K2APIK3CG
SCHEMBL4412925 0.75 PIP4K2A (0.48) EGFRKDRPIP4K2APIK3CG
SCHEMBL4413342 0.75 MAP4K4 (0.47) PIP4K2APIK3CGAURKARPS6KB1AURKB
SCHEMBL18696242 0.74 ABL1 (0.59) FLT3ABL1BCREGFRKDR
SCHEMBL6454592 0.74 MAPT (0.52) KDR
SCHEMBL4415185 0.74 LMNA (0.58) EGFRPIP4K2APIK3CG
SCHEMBL4414264 0.74 MAPT (0.57) ABL1EGFRTTBK1

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
EP-1658290-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-15 EP claimed
CN-100439365-C Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-12-03 CN claimed
US-7338957-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-03-04 US claimed
JP-2007504159-A 2007-03-01 JP claimed
CN-1842529-A Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2006-10-04 CN claimed
EP-1658290-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-24 EP claimed
WO-2005039486-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-05-06 WO claimed
EP-1658290-A4 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2009-04-15 EP disclosed
CN-100439365-C Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-12-03 CN disclosed
US-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2008-05-08 US disclosed
US-7338957-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2008-03-04 US disclosed
CN-1842529-A Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2006-10-04 CN disclosed
EP-1658290-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2006-05-24 EP disclosed
WO-2005039486-A2 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2005-05-06 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-20080108616-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS LCK, FYN, BMX FLT3 102/4885ABL1 53/4885BCR 64/4885

“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.