SCHEMBL4887090

SCHEMBL4887090

O=C(Nc1cc(Oc2ccc(NC(=O)N3CCN(c4cccc(C(F)(F)F)c4)C3=S)cc2F)ccn1)N1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.54
BRAF P15056 8/20 0.54
AXL P30530 1/20 0.48
MET P08581 1/20 0.47
MAPT P10636 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
SCHEMBL4882755 0.90 MET (0.56) KDRAXLMET
SCHEMBL4884736 0.87 AXL (0.59) KDRAXLMET
SCHEMBL4884069 0.85 MET (0.52) KDRBRAFAXLMET
SCHEMBL4728517 0.82 MET (0.62) KDRAXLMET
SCHEMBL4888377 0.80 AXL (0.49) KDRBRAFAXLMET
SCHEMBL4887103 0.79 AXL (0.62) KDRAXLMET
SCHEMBL4888445 0.78 MET (0.56) KDRBRAFMET
SCHEMBL4889760 0.76 AXL (0.59) KDRBRAFAXLMET
SCHEMBL4329349 0.75 AXL (0.54) KDRBRAFAXLMET
SCHEMBL4882739 0.75 KDR (0.55) KDRBRAFAXLMET

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-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 US disclosed
US-20080255155-A1 KINASE INHIBITORS AND USES THEREOF METHLYGENE INC. (CA) 2008-10-16 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-20080255155-A1 KINASE INHIBITORS AND USES THEREOF ABL1, MAP3K20, MAP3K1 KDR 746/4885BRAF 26/4885AXL 475/4885

“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.