SCHEMBL4361704

SCHEMBL4361704

Nc1nccn2c(C3CCC3)nc(-c3ccc(-c4cc5ccccc5[nH]4)cc3)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TNK2 Q07912 18/20 1.00
FGFR1 P11362 1/20 0.67
RAF1 P04049 1/20 0.62
SRC P12931 1/20 0.62

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
SCHEMBL593645 0.92 TNK2 (0.85) TNK2FGFR1RAF1SRC
SCHEMBL12165303 0.89 TNK2 (0.80) TNK2FGFR1RAF1SRC
SCHEMBL593475 0.84 TNK2 (0.72) TNK2FGFR1RAF1SRC
Hydrochloric Acid SCHEMBL594350 0.83 TNK2 (0.71) TNK2FGFR1RAF1SRC
SCHEMBL2462683 0.83 TNK2 (0.83) TNK2
SCHEMBL4356359 0.82 TNK2 (1.00) TNK2
SCHEMBL8181452 0.82 RAF1 (0.75) TNK2FGFR1RAF1SRC
SCHEMBL593343 0.82 IGF1R (0.75) TNK2FGFR1RAF1SRC
SCHEMBL593344 0.82 IGF1R (0.75) TNK2FGFR1RAF1SRC
SCHEMBL593994 0.81 PIK3CA (0.76) TNK2FGFR1RAF1SRC

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-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 US disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 US disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 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-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 TNK2 2837/4885FGFR1 163/4885RAF1 970/4885

“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.