SCHEMBL10205116

SCHEMBL10205116

COc1cc(N2CCN(C(=O)CN(C)C)CC2)ccc1Nc1ncc(Cl)c(NCc2cccc3c2C(C)(C)C(=O)N3)n1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 14/20 0.58
▸ EGFR P00533 3/20 0.54
▸ JAK3 P52333 4/20 0.53
▸ JAK2 O60674 2/20 0.53
▸ JAK1 P23458 1/20 0.53
▸ TTK P33981 1/20 0.53
▸ FLT3 P36888 1/20 0.53
▸ TXK P42681 1/20 0.53
▸ BLK P51451 1/20 0.53
▸ BTK Q06187 1/20 0.53
▸ ITK Q08881 1/20 0.53
▸ SRC P12931 1/20 0.51
▸ TNK2 Q07912 1/20 0.51

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
SCHEMBL10205133 0.93 ALK (0.56) ALKEGFRJAK3JAK2JAK1
SCHEMBL14331718 0.92 ALK (0.59) ALKEGFRJAK3
SCHEMBL10206181 0.91 ALK (0.66) ALKEGFR
SCHEMBL10205106 0.91 EGFR (0.51) ALKEGFRJAK3JAK2JAK1
SCHEMBL10205114 0.89 ALK (0.56) ALKEGFRJAK3JAK2JAK1
SCHEMBL10205105 0.89 JAK3 (0.58) ALKEGFRJAK3JAK2JAK1
SCHEMBL10205136 0.89 ALK (0.60) ALKEGFR
SCHEMBL10205505 0.88 ALK (0.65) ALKEGFRJAK3JAK2JAK1
SCHEMBL10205109 0.88 JAK3 (0.57) ALKEGFRJAK3JAK2JAK1
SCHEMBL10205509 0.87 ALK (0.55) ALKEGFRJAK3JAK2JAK1

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 ALK 2575/4885EGFR 1397/4885JAK3 1636/4885

“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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