SCHEMBL10205507

SCHEMBL10205507

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

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 10/20 0.58
▸ ALK Q9UM73 4/20 0.58
▸ INSR P06213 1/20 0.58
▸ IGF1R P08069 1/20 0.58
▸ TNK2 Q07912 4/20 0.52
▸ JAK2 O60674 3/20 0.51
▸ SRC P12931 2/20 0.51
▸ MAPK7 Q13164 1/20 0.51
▸ JAK3 P52333 4/20 0.49
▸ JAK1 P23458 1/20 0.49
▸ TTK P33981 1/20 0.49
▸ FLT3 P36888 1/20 0.49
▸ TXK P42681 1/20 0.49
▸ BLK P51451 1/20 0.49
▸ BTK Q06187 1/20 0.49
▸ ITK Q08881 1/20 0.49
▸ MET P08581 1/20 0.48

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
SCHEMBL10207088 0.92 EGFR (0.51) EGFRALKINSRIGF1RTNK2
SCHEMBL10205209 0.91 ALK (0.47) EGFRALKINSRIGF1RTNK2
SCHEMBL10206144 0.91 EGFR (0.59) EGFRALKINSRIGF1RMET
SCHEMBL16255608 0.91 EGFR (0.47) EGFRALKINSRIGF1RTNK2
SCHEMBL14331632 0.90 EGFR (0.49) EGFRALKINSRIGF1RTNK2
SCHEMBL10205922 0.90 ALK (0.58) EGFRALKINSRIGF1RJAK2
SCHEMBL10206631 0.90 EGFR (0.51) EGFRALKINSRIGF1RTNK2
SCHEMBL10207044 0.89 EGFR (0.51) EGFRALKINSRIGF1RMET
SCHEMBL10205106 0.89 EGFR (0.51) EGFRALKINSRIGF1RJAK2
SCHEMBL10205505 0.89 ALK (0.65) EGFRALKINSRIGF1RTNK2

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 1397/4885ALK 2575/4885INSR 1352/4885

“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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