SCHEMBL5953085

SCHEMBL5953085

Cc1cc2nc(-c3n[nH]c4ccc(F)cc34)[nH]c2cc1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 4/20 0.51
MAP3K8 P41279 3/20 0.51
ITK Q08881 3/20 0.50
GUSB P08236 2/20 0.50
FLT3 P36888 3/20 0.49
CLK4 Q9HAZ1 2/20 0.49
PDPK1 O15530 4/20 0.49
METAP2 P50579 1/20 0.47
METAP1 P53582 1/20 0.47
CBFB Q13951 1/20 0.47
FLT1 P17948 2/20 0.47
CHEK1 O14757 2/20 0.46
PLK4 O00444 1/20 0.46
AURKA O14965 1/20 0.46
CHUK O15111 1/20 0.46
JAK2 O60674 1/20 0.46
ROCK2 O75116 1/20 0.46
MAP4K4 O95819 1/20 0.46
PAK4 O96013 1/20 0.46
CHEK2 O96017 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
SCHEMBL5953214 0.89 CHEK1 (0.53) FGFR1ITKGUSBFLT3CLK4
SCHEMBL3537973 0.88 PDPK1 (0.51) FGFR1MAP3K8ITKFLT3CLK4
SCHEMBL5952153 0.86 ITK (0.55) FGFR1MAP3K8ITKFLT3CLK4
SCHEMBL5951667 0.84 MAP3K8 (0.51) FGFR1MAP3K8ITKGUSBFLT3
SCHEMBL5952142 0.84 ITK (0.62) FGFR1MAP3K8ITKGUSBFLT3
SCHEMBL3538485 0.83 PDPK1 (0.51) FGFR1ITKFLT3CLK4PDPK1
SCHEMBL3533017 0.82 PDPK1 (0.71) FGFR1ITKFLT3CLK4PDPK1
SCHEMBL4912661 0.82 FGFR1 (0.70) FGFR1ITKFLT3CLK4PDPK1
SCHEMBL5952280 0.82 AMY1A (0.58) FGFR1MAP3K8ITKFLT3CLK4
SCHEMBL13373869 0.81 MAP3K8 (0.48) FGFR1MAP3K8ITKFLT3CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060014756-A1 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2006-01-19 US claimed
US-6897208-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US claimed
EP-1441725-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS Aventis Pharmaceuticals Inc. (US) 2004-08-04 EP claimed
US-20040048868-A1 Benzimidazoles AVENTISUB LLC 2004-03-11 US claimed
WO-2003035065-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2003-05-01 WO claimed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-8288425-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2012-10-16 US disclosed
US-20060014756-A1 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2006-01-19 US disclosed
US-6897208-B2 Benzimidazoles AVENTIS PHARMACEUTICALS INC. (US) 2005-05-24 US disclosed
EP-1441725-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS Aventis Pharmaceuticals Inc. (US) 2004-08-04 EP disclosed
US-20040048868-A1 Benzimidazoles AVENTISUB LLC 2004-03-11 US disclosed
WO-2003035065-A1 BENZIMIDAZOLES AND ANALOGUES AND THEIR USE AS PROTEIN KINASES INHIBITORS AVENTIS PHARMACEUTICALS INC (US) 2003-05-01 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 (2 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-20060014756-A1 Benzimidazoles CDK9, BMX, SBK3 FGFR1 583/4885MAP3K8 35/4885ITK 979/4885
US-20040048868-A1 Benzimidazoles CDK9, BMX, CDKN1A FGFR1 254/4885MAP3K8 40/4885ITK 1317/4885

“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.