SCHEMBL4814852

SCHEMBL4814852

O=C(Nc1ccc(Oc2ccnc3[nH]ccc23)cc1C(F)(F)F)c1cccn(-c2ccc(F)cc2)c1=O

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.67
RIPK3 Q9Y572 5/20 0.67
RIPK1 Q13546 2/20 0.67
KIT P10721 2/20 0.67
FLT3 P36888 2/20 0.67
LCK P06239 1/20 0.67
KDR P35968 1/20 0.67
AURKA O14965 1/20 0.51
AXL P30530 2/20 0.49
TYRO3 Q06418 1/20 0.49
MERTK Q12866 1/20 0.49

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
SCHEMBL4820509 0.89 MET (0.69) METRIPK3RIPK1KITFLT3
SCHEMBL4820487 0.89 MET (0.68) METRIPK3RIPK1KITFLT3
SCHEMBL4822769 0.87 MET (0.66) METRIPK3RIPK1KITFLT3
SCHEMBL14018080 0.86 MET (0.80) METRIPK3RIPK1KITFLT3
SCHEMBL4822296 0.84 MET (0.75) METRIPK3RIPK1KITFLT3
SCHEMBL4818940 0.83 MET (0.79) METRIPK3RIPK1KITFLT3
SCHEMBL4820707 0.82 MET (0.77) METRIPK3RIPK1KITFLT3
SCHEMBL14018100 0.81 MET (0.76) METRIPK3RIPK1KITFLT3
SCHEMBL4816591 0.81 MET (0.76) METRIPK3RIPK1KITFLT3
SCHEMBL4812419 0.81 MET (0.70) METRIPK3RIPK1KITFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US claimed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-7439246-B2 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2008-10-21 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-7173031-B2 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2007-02-06 US disclosed
US-20060211695-A1 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2006-09-21 US disclosed
US-20060004006-A1 Pyrrolotriazine kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2006-01-05 US disclosed
US-20050288290-A1 Fused heterocyclic kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2005-12-29 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 (3 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-20050288290-A1 Fused heterocyclic kinase inhibitors MAP3K20, MAP3K19, ABL1 MET 721/4885RIPK3 280/4885RIPK1 307/4885
US-20060004006-A1 Pyrrolotriazine kinase inhibitors MAP3K5, MAP3K15, MAP4K2 MET 2109/4885RIPK3 177/4885RIPK1 175/4885
US-20060211695-A1 Fused heterocyclic kinase inhibitors MAP3K20, MAP3K19, ABL1 MET 721/4885RIPK3 280/4885RIPK1 307/4885

“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.