SCHEMBL10207025

SCHEMBL10207025

COc1cc(C2CCCNC2)ccc1Nc1ncc(Br)c(NCc2cccc3c2C(C)(C)C(=O)N3)n1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 9/20 0.49
▸ IGF1R P08069 3/20 0.43
▸ NTRK1 P04629 2/20 0.43
▸ MET P08581 1/20 0.42
▸ ALK Q9UM73 2/20 0.41
▸ JAK3 P52333 2/20 0.41
▸ FLT4 P35916 1/20 0.39
▸ PTK2 Q05397 1/20 0.39
▸ TNK2 Q07912 2/20 0.39

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
SCHEMBL10205527 0.92 EGFR (0.49) EGFRIGF1RNTRK1METALK
SCHEMBL10205524 0.92 EGFR (0.58) EGFRIGF1RMETALKFLT4
SCHEMBL10205522 0.92 NTRK1 (0.41) EGFRIGF1RNTRK1FLT4PTK2
SCHEMBL10207023 0.91 NTRK1 (0.40) EGFRIGF1RNTRK1TNK2
SCHEMBL10205879 0.90 EGFR (0.51) EGFRALKFLT4PTK2
SCHEMBL10207024 0.88 TNK2 (0.46) IGF1RNTRK1PTK2TNK2
SCHEMBL10207080 0.86 TNK2 (0.44) EGFRIGF1RNTRK1ALKJAK3
SCHEMBL10207058 0.86 TNK2 (0.47) EGFRIGF1RALKJAK3TNK2
SCHEMBL10205207 0.85 TNK2 (0.42) EGFRIGF1RNTRK1ALKJAK3
SCHEMBL10206144 0.84 EGFR (0.59) EGFRIGF1RMETALKFLT4

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 EGFR 1397/4885IGF1R 860/4885NTRK1 2690/4885

“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.

Send feedback