SCHEMBL2824311

SCHEMBL2824311

CN1C(=O)C(=C(N)c2ccccc2)c2ccccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ HPGD P15428 3/20 0.52
▸ F2 P00734 1/20 0.52
▸ ATM Q13315 1/20 0.52
▸ TTR P02766 3/20 0.51
▸ CES1 P23141 1/20 0.51
▸ RAB9A P51151 2/20 0.45
▸ TRPA1 O75762 1/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ MTOR P42345 1/20 0.45
▸ EPHX2 P34913 2/20 0.44
▸ LRRK2 Q5S007 1/20 0.43
▸ MAPT P10636 5/20 0.43
▸ HSP90AA1 P07900 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ NR1H2 P55055 2/20 0.43
▸ NR1H3 Q13133 2/20 0.43
▸ MAPK1 P28482 2/20 0.42

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
SCHEMBL2824309 1.00 ALDH1A1 (0.52) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL13207350 1.00 ALDH1A1 (0.52) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL13207353 0.89 TTR (0.47) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL2826794 0.89 TTR (0.47) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL2826795 0.89 TTR (0.47) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL2825807 0.88 TTR (0.46) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL2825805 0.88 TTR (0.46) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL13207329 0.88 TTR (0.46) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL13207363 0.86 HSP90AA1 (0.60) ALDH1A1KMT2AHPGDF2ATM
SCHEMBL2826004 0.86 HSP90AA1 (0.60) ALDH1A1KMT2AHPGDF2ATM

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7781475-B2 Oxindoles as kinase inhibitors MERCK PATENT GMBH (DE) 2010-08-24 — — US claimed
US-20100197757-A1 OXINDOLES AS KINASE INHIBITORS BURGDORF LARS THORE 2010-08-05 — — US claimed
US-20090131506-A1 Oxindoles as Kinase Inhibitors MERCK PATENT GMBH (DE) 2009-05-21 — — US claimed
EP-1891008-A1 OXINDOLES AS KINASE INHIBITORS Merck Patent GmbH (DE) 2008-02-27 — — EP claimed
WO-2006131186-A1 OXINDOLES AS KINASE INHIBITORS MERCK PATENT GMBH (DE) 2006-12-14 — — WO claimed
US-7781475-B2 Oxindoles as kinase inhibitors MERCK PATENT GMBH (DE) 2010-08-24 — — US disclosed
US-20100197757-A1 OXINDOLES AS KINASE INHIBITORS BURGDORF LARS THORE 2010-08-05 — — US disclosed
EP-1891008-B1 OXINDOLES AS KINASE INHIBITORS MERCK PATENT GMBH (DE) 2010-06-30 — — EP disclosed
US-20090131506-A1 Oxindoles as Kinase Inhibitors MERCK PATENT GMBH (DE) 2009-05-21 — — US 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 (2 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-20100197757-A1 OXINDOLES AS KINASE INHIBITORS MAP4K2, MAP3K20, MAP3K1 ALDH1A1 2486/4885KMT2A 1356/4885HPGD 1125/4885
US-20090131506-A1 Oxindoles as Kinase Inhibitors MAP4K2, MAP3K20, MAP3K1 ALDH1A1 2486/4885KMT2A 1356/4885HPGD 1125/4885

“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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