SCHEMBL10205920

SCHEMBL10205920

CCc1cc(C2CCCN(CCOC)C2)ccc1Nc1ncc(Br)c(NCc2cccc3c2C(C)(C)C(=O)N3)n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TNK2 Q07912 3/20 0.38
▸ JAK3 P52333 1/20 0.37
▸ LRRK2 Q5S007 4/20 0.37
▸ EGFR P00533 5/20 0.36
▸ IGF1R P08069 3/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ ALK Q9UM73 2/20 0.34
▸ INSR P06213 1/20 0.34
▸ CDK1 P06493 1/20 0.34
▸ FLT4 P35916 1/20 0.34
▸ PTK2 Q05397 1/20 0.34

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
SCHEMBL10207080 0.94 TNK2 (0.44) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10207081 0.94 TNK2 (0.39) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205204 0.94 TNK2 (0.39) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205205 0.94 TNK2 (0.39) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205896 0.93 ALK (0.40) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205936 0.93 TNK2 (0.41) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205927 0.91 TNK2 (0.39) TNK2JAK3IGF1RNTRK1ALK
SCHEMBL10207058 0.88 TNK2 (0.47) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205195 0.87 ALK (0.47) TNK2JAK3LRRK2EGFRIGF1R
SCHEMBL10205196 0.87 ALK (0.40) TNK2JAK3EGFRIGF1RALK

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 TNK2 646/4885JAK3 1636/4885LRRK2 677/4885

“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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