SCHEMBL10205197

SCHEMBL10205197

COCCN1CCCC(c2ccc(Nc3ncc(Cl)c(NCc4cccc5c4C(C)(C)C(=O)N5)n3)cc2)C1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALK Q9UM73 9/20 0.43
▸ INSR P06213 7/20 0.43
▸ MET P08581 4/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ AURKA O14965 1/20 0.40
▸ JAK2 O60674 1/20 0.40
▸ JAK1 P23458 1/20 0.40
▸ TYK2 P29597 1/20 0.40
▸ TTK P33981 1/20 0.40
▸ STK17A Q9UEE5 1/20 0.39
▸ TNK2 Q07912 1/20 0.39
▸ NTRK1 P04629 1/20 0.39
▸ CCNT1 O60563 1/20 0.39
▸ CCNK O75909 1/20 0.39
▸ CCNE1 P24864 1/20 0.39
▸ CDK2 P24941 1/20 0.39
▸ CDK7 P50613 1/20 0.39
▸ CDK9 P50750 1/20 0.39
▸ CCNH P51946 1/20 0.39
▸ MNAT1 P51948 1/20 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
SCHEMBL10205927 0.92 TNK2 (0.39) ALKINSRJAK3AURKAJAK2
SCHEMBL10206622 0.92 ALK (0.44) ALKINSRMETJAK3AURKA
SCHEMBL10205202 0.92 JAK3 (0.40) JAK3JAK2JAK1STK17ATNK2
SCHEMBL10205896 0.91 ALK (0.40) ALKINSRMETJAK3AURKA
SCHEMBL10205196 0.90 ALK (0.40) ALKINSRMETJAK3JAK2
SCHEMBL10205195 0.90 ALK (0.47) ALKINSRMETJAK3JAK2
SCHEMBL10205194 0.87 JAK3 (0.42) ALKJAK3JAK2JAK1TYK2
SCHEMBL10206632 0.85 PTK2 (0.41) ALKJAK3JAK2TYK2STK17A
SCHEMBL10205200 0.85 ALK (0.47) ALKINSRMETJAK3AURKA
SCHEMBL10205220 0.84 STAT6 (0.42) ALKINSRMETJAK3TNK2

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 ALK 2575/4885INSR 1352/4885MET 2385/4885

“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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