SCHEMBL10206198

SCHEMBL10206198

CC1(C)C(=O)Nc2cccc(CNc3nc(Nc4ccc(C5CCN(CCCF)CC5)cc4)ncc3Br)c21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ STAT6 P42226 1/20 0.42
▸ TNK2 Q07912 3/20 0.42
▸ CDK1 P06493 1/20 0.40
▸ TBK1 Q9UHD2 2/20 0.38
▸ PTK2 Q05397 5/20 0.38
▸ PTK2B Q14289 1/20 0.38
▸ IGF1R P08069 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ STK17A Q9UEE5 1/20 0.37
▸ FLT4 P35916 1/20 0.37
▸ KDR P35968 1/20 0.37
▸ JAK3 P52333 1/20 0.37
▸ HTR7 P34969 1/20 0.37
▸ WEE1 P30291 1/20 0.37
▸ BRD4 O60885 1/20 0.37

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
SCHEMBL10206199 0.92 STK17A (0.46) STAT6TNK2PTK2KCNH2STK17A
SCHEMBL10206634 0.92 STAT6 (0.44) STAT6TNK2CDK1TBK1PTK2
SCHEMBL10205220 0.91 STAT6 (0.42) STAT6TNK2CDK1PTK2PTK2B
SCHEMBL10205216 0.88 STAT6 (0.42) STAT6TNK2CDK1PTK2PTK2B
SCHEMBL10207050 0.86 TNK2 (0.54) TNK2CDK1PTK2PTK2BSTK17A
SCHEMBL10207078 0.84 STAT6 (0.40) STAT6TNK2CDK1TBK1PTK2
SCHEMBL10205863 0.84 STAT6 (0.43) STAT6TNK2CDK1TBK1PTK2
SCHEMBL10205861 0.84 STAT6 (0.43) STAT6TNK2CDK1TBK1PTK2
SCHEMBL14331602 0.84 STAT6 (0.43) STAT6TNK2CDK1TBK1PTK2
SCHEMBL10206633 0.84 EGFR (0.46) STAT6TNK2KCNH2STK17AFLT4

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 STAT6 1155/4885TNK2 646/4885CDK1 21/4885

“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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