SCHEMBL3537689

SCHEMBL3537689

CC1COC(CN(C)C)CN1c1ccc2nc(-c3n[nH]c4ccc(NC(=O)c5ccc(F)cc5F)cc34)[nH]c2c1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 9/20 0.48
ABL1 P00519 2/20 0.45
BCR P11274 2/20 0.45
FGFR1 P11362 2/20 0.44
FLT1 P17948 2/20 0.44
FLT3 P36888 6/20 0.43
CHEK1 O14757 1/20 0.41
MLLT1 Q03111 1/20 0.41

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
SCHEMBL3538555 0.95 CHEK1 (0.46) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL3536048 0.88 PDPK1 (0.38) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL3538269 0.88 PDPK1 (0.47) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL3532328 0.88 PDPK1 (0.52) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL3535881 0.87 PDPK1 (0.46) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL5866797 0.86 PDPK1 (0.51) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL3538016 0.83 CHEK1 (0.43) PDPK1ABL1BCRFLT3CHEK1
SCHEMBL3532679 0.82 PDPK1 (0.46) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL5866785 0.81 PDPK1 (0.44) PDPK1ABL1BCRFGFR1FLT1
SCHEMBL3532400 0.80 FGFR1 (0.54) PDPK1ABL1BCRFGFR1FLT1

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-7642278-B2 Nitrogen compounds such as 3-(5-morpholin-4-yl-1H-benz-imidazol-2-yl)-1H-indazole and/or isomers, used as immunology modulators, antidiabetic agents, antiogenesis inhibitors or for prophylaxis of Alzheimer's disease NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2010-01-05 US disclosed
US-7064215-B2 Indazole benzimidazole compounds CHIRON CORPORATION (US) 2006-06-20 US disclosed
US-20060079564-A1 Indazole benzimidazole compounds CHIRON CORPORATION 2006-04-13 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-20060079564-A1 Indazole benzimidazole compounds ABL1, ABL2, ALK PDPK1 1862/4885ABL1 1/4885BCR 94/4885

“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.