SCHEMBL10205106

SCHEMBL10205106

COc1cc(C2CCN(C(=O)CN(C)C)CC2)ccc1Nc1ncc(Cl)c(NCc2cccc3c2C(C)(C)C(=O)N3)n1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 10/20 0.51
▸ ALK Q9UM73 6/20 0.49
▸ IGF1R P08069 3/20 0.48
▸ INSR P06213 2/20 0.47
▸ KCNH2 Q12809 2/20 0.46
▸ LRRK2 Q5S007 1/20 0.45
▸ MET P08581 1/20 0.44
▸ JAK3 P52333 2/20 0.44
▸ JAK2 O60674 1/20 0.44
▸ JAK1 P23458 1/20 0.44
▸ TTK P33981 1/20 0.44
▸ FLT3 P36888 1/20 0.44
▸ TXK P42681 1/20 0.44
▸ BLK P51451 1/20 0.44
▸ BTK Q06187 1/20 0.44
▸ ITK Q08881 1/20 0.44

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
SCHEMBL10205922 0.93 ALK (0.58) EGFRALKIGF1RINSRKCNH2
SCHEMBL10205548 0.93 ALK (0.49) EGFRALKIGF1RLRRK2JAK3
SCHEMBL10205534 0.92 ALK (0.46) EGFRALKIGF1RINSRKCNH2
SCHEMBL10205116 0.91 ALK (0.58) EGFRALKJAK3JAK2JAK1
SCHEMBL10207044 0.90 EGFR (0.51) EGFRALKIGF1RINSRKCNH2
SCHEMBL10205507 0.89 EGFR (0.58) EGFRALKIGF1RINSRMET
SCHEMBL14331659 0.89 NTRK1 (0.44) ALKINSRKCNH2METJAK3
SCHEMBL10207088 0.87 EGFR (0.51) EGFRALKIGF1RINSRKCNH2
SCHEMBL10206144 0.86 EGFR (0.59) EGFRALKIGF1RINSRKCNH2
SCHEMBL10205151 0.86 EGFR (0.44) EGFRALKIGF1RINSRKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2655358-B1 OXINDOLOPYRIMIDINE AS IGF1R RECEPTOR INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2014-11-19 — — EP disclosed
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 EGFR 1397/4885ALK 2575/4885IGF1R 860/4885

“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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