SCHEMBL5440735

SCHEMBL5440735

Cn1cc(-c2cc(Oc3cccc(NC(=O)c4ccccc4C(F)(F)F)c3)ccn2)cn1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.61
AXL P30530 6/20 0.52
NTRK1 P04629 1/20 0.51
KCNK3 O14649 3/20 0.49
KCNK9 Q9NPC2 3/20 0.49
CSF1R P07333 6/20 0.48
PDGFRB P09619 4/20 0.48
PDGFRA P16234 4/20 0.48
MET P08581 3/20 0.48
FLT3 P36888 2/20 0.48
CYP2C9 P11712 1/20 0.47
PTGES O14684 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
SCHEMBL5436248 0.89 KDR (0.54) KDRAXLNTRK1KCNK3KCNK9
SCHEMBL5440253 0.87 AXL (0.54) KDRAXLCSF1RPDGFRBPDGFRA
SCHEMBL5443568 0.86 KDR (0.58) KDRAXLNTRK1CSF1RPDGFRB
SCHEMBL5443642 0.86 AXL (0.51) KDRAXLCSF1RPDGFRBPDGFRA
SCHEMBL5443654 0.86 AXL (0.51) KDRAXLNTRK1CSF1RPDGFRB
SCHEMBL5441873 0.85 NTRK1 (0.61) KDRAXLNTRK1CSF1RPDGFRB
SCHEMBL5338565 0.85 KDR (0.71) KDRAXLCSF1R
SCHEMBL5335714 0.84 AXL (0.50) KDRAXLNTRK1CSF1RPDGFRB
SCHEMBL27864410 0.84 KDR (0.72) KDRNTRK1CSF1RPDGFRBPDGFRA
SCHEMBL28793967 0.84 KDR (0.72) KDRNTRK1CSF1RPDGFRBPDGFRA

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-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 US disclosed
US-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 US disclosed
US-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES KALYPSYS, INC. (US) 2007-07-05 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-20070155746-A1 NOVEL SUBSTITUTED PYRIDINYLOXY AND PYRIMIDINYLOXY AMIDES USEFUL AS INHIBITORS OF PROTEIN KINASES BRAF, ARAF, RAF1 KDR 508/4885AXL 7/4885NTRK1 358/4885

“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.