SCHEMBL4819907

SCHEMBL4819907

Cc1cc(Oc2ccnc3[nH]ccc23)ccc1C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 16/20 0.52
NUDT1 P36639 2/20 0.47
BRAF P15056 1/20 0.47
KDR P35968 1/20 0.47
MAPK14 Q16539 1/20 0.47
TNNI3K Q59H18 1/20 0.47
IKBKB O14920 1/20 0.45
CHUK O15111 1/20 0.45

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
SCHEMBL4817306 0.86 MET (0.49) METNUDT1BRAFKDRMAPK14
SCHEMBL4814426 0.83 KDR (0.54) METNUDT1BRAFKDRMAPK14
SCHEMBL4819914 0.82 MET (0.48) METBRAFKDRMAPK14TNNI3K
SCHEMBL14018113 0.81 MET (0.53) METBRAFKDRMAPK14TNNI3K
SCHEMBL31061568 0.80 MAP3K7 (0.53) METNUDT1KDRMAPK14IKBKB
SCHEMBL1591677 0.77 KDR (0.70) METKDR
SCHEMBL4369928 0.75 MET (0.47) METBRAFKDRMAPK14TNNI3K
SCHEMBL4363236 0.74 MET (0.47) METBRAFKDRMAPK14TNNI3K
SCHEMBL14018120 0.73 MET (0.64) METBRAFKDRMAPK14TNNI3K
SCHEMBL4819121 0.73 IKBKB (0.52) METIKBKBCHUK

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 6 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-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 721/4885NUDT1 1017/4885BRAF 55/4885
US-20060004006-A1 Pyrrolotriazine kinase inhibitors MAP3K5, MAP3K15, MAP4K2 MET 2109/4885NUDT1 1866/4885BRAF 201/4885
US-20060211695-A1 Fused heterocyclic kinase inhibitors MAP3K20, MAP3K19, ABL1 MET 721/4885NUDT1 1017/4885BRAF 55/4885

“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.