SCHEMBL10205090

SCHEMBL10205090

CC1(C)C(=O)Nc2cccc(CNc3nc(Nc4ccc(C5CCCNC5)c5c4OCO5)ncc3C(F)(F)F)c21

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ LRRK2 Q5S007 2/20 0.41
▸ FLT3 P36888 3/20 0.41
▸ NTRK1 P04629 6/20 0.40
▸ PTK2 Q05397 6/20 0.40
▸ PTK2B Q14289 2/20 0.38
▸ CHEK1 O14757 3/20 0.38
▸ AURKA O14965 1/20 0.36
▸ BRD4 O60885 1/20 0.36

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
SCHEMBL10205081 0.92 FLT3 (0.42) LRRK2FLT3NTRK1PTK2PTK2B
SCHEMBL10205086 0.90 NTRK1 (0.41) FLT3NTRK1PTK2PTK2BCHEK1
SCHEMBL10205076 0.89 NTRK1 (0.42) FLT3NTRK1PTK2PTK2BCHEK1
SCHEMBL10206117 0.87 PTK2 (0.43) FLT3NTRK1PTK2PTK2B
SCHEMBL10205879 0.86 EGFR (0.51) FLT3PTK2
SCHEMBL16255577 0.85 LRRK2 (0.38) LRRK2FLT3NTRK1PTK2PTK2B
SCHEMBL10206652 0.85 LRRK2 (0.38) LRRK2NTRK1PTK2PTK2B
SCHEMBL10205875 0.84 LRRK2 (0.39) LRRK2NTRK1PTK2PTK2BAURKA
SCHEMBL14331604 0.84 EGFR (0.41) LRRK2PTK2PTK2B
SCHEMBL10205539 0.83 ALK (0.42) LRRK2PTK2

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 LRRK2 677/4885FLT3 2667/4885NTRK1 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.

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