SCHEMBL10205173

SCHEMBL10205173

COCCN1CCCC(c2ccc(Nc3ncc(C(F)(F)F)c(NCc4cccc5c4C(C)(C)C(=O)N5)n3)c(C)c2)C1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTK2 Q05397 9/20 0.42
▸ FLT4 P35916 3/20 0.42
▸ EGFR P00533 8/20 0.41
▸ ALK Q9UM73 1/20 0.40
▸ JAK3 P52333 1/20 0.38
▸ PTK2B Q14289 2/20 0.38
▸ TNK2 Q07912 1/20 0.38

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
SCHEMBL10205938 0.94 EGFR (0.48) PTK2FLT4EGFRALKJAK3
SCHEMBL10205178 0.93 EGFR (0.48) PTK2FLT4EGFRALKJAK3
SCHEMBL10205170 0.93 PTK2 (0.45) PTK2FLT4EGFRALKJAK3
SCHEMBL10205196 0.91 ALK (0.40) EGFRALKJAK3TNK2
SCHEMBL10205205 0.91 TNK2 (0.39) PTK2FLT4EGFRALKJAK3
SCHEMBL10207081 0.91 TNK2 (0.39) PTK2FLT4EGFRALKJAK3
SCHEMBL10205204 0.91 TNK2 (0.39) PTK2FLT4EGFRALKJAK3
SCHEMBL10205908 0.89 PTK2 (0.43) PTK2FLT4EGFRALKPTK2B
SCHEMBL10205177 0.88 ALK (0.51) PTK2FLT4EGFRALKJAK3
SCHEMBL10205912 0.87 PTK2 (0.55) PTK2FLT4EGFRALKJAK3

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-8546443-B2 Benzylic oxindole pyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-10-01 — — US disclosed
US-20120329771-A1 BENZYLIC OXINDOLE PYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-12-27 — — US disclosed
WO-2012085126-A1 OXINDOLOPYRIMIDINE AS IGF1R RECEPTOR INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-28 — — 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 (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-20120329771-A1 BENZYLIC OXINDOLE PYRIMIDINES MKI67, CCNI, CCNB1 PTK2 1524/4885FLT4 2572/4885EGFR 1397/4885

“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.

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