SCHEMBL5619602

SCHEMBL5619602

O=C(O)/C(=C1\C(=O)Nc2ccccc21)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 4/20 0.50
▸ TDO2 P48775 1/20 0.50
▸ TDP1 Q9NUW8 2/20 0.49
▸ LRRK2 Q5S007 2/20 0.47
▸ MAOA P21397 1/20 0.47
▸ MAOB P27338 1/20 0.47
▸ PDGFRA P16234 1/20 0.47
▸ FER P16591 1/20 0.47
▸ LTK P29376 1/20 0.47
▸ CDK8 P49336 1/20 0.47
▸ ACVR1 Q04771 1/20 0.47
▸ DYRK1B Q9Y463 1/20 0.47
▸ ALDH1A1 P00352 3/20 0.46
▸ MAPT P10636 3/20 0.46
▸ NPSR1 Q6W5P4 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.46

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
SCHEMBL5619605 1.00 IDO1 (0.50) IDO1TDO2TDP1LRRK2MAOA
SCHEMBL14515139 1.00 IDO1 (0.50) IDO1TDO2TDP1LRRK2MAOA
SCHEMBL14515157 0.83 CCNB2 (0.60) LRRK2MAPTMEN1KMT2APDPK1
SCHEMBL5618358 0.83 CCNB2 (0.60) LRRK2MAPTMEN1KMT2APDPK1
SCHEMBL5618363 0.83 CCNB2 (0.60) LRRK2MAPTMEN1KMT2APDPK1
SCHEMBL7006381 0.81 TDP1 (0.69) IDO1TDO2TDP1LRRK2MAOA
SCHEMBL2829329 0.78 TDP1 (0.50) IDO1TDO2TDP1LRRK2MAOA
SCHEMBL1465398 0.78 TDP1 (0.54) IDO1TDO2TDP1LRRK2MAOA
SCHEMBL1466156 0.78 TDP1 (0.54) IDO1TDO2TDP1LRRK2MAOA
SCHEMBL2829327 0.78 TDP1 (0.50) IDO1TDO2TDP1LRRK2MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7214700-B2 (2-Oxindol-3-ylidenyl) acetic acid derivatives and their use as protein kinase inhibitors SUGEN INC. (US) 2007-05-08 — — US disclosed
US-20040039196-A1 (2-Oxindol-3-ylidenyl) acetic acid derivatives and their use as protein kinase inhibitors SUGEN, INC. 2004-02-26 — — US disclosed
US-20030216462-A1 (2-Oxindol-3-ylidenyl) acetic acid derivatives and their use as protein kinase inhibitors SUGEN, INC. 2003-11-20 — — US disclosed
US-20020028828-A1 (2-oxindol-3-ylidenyl)acetic acid derivatives and their use as protein kinase inhibitors SUGEN, INC. 2002-03-07 — — 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 (3 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-20020028828-A1 (2-oxindol-3-ylidenyl)acetic acid derivatives and their use as protein kinase inhibitors MAPKAPK2, MAPKAPK3, MAP3K2 IDO1 1262/4885TDO2 1921/4885TDP1 2581/4885
US-20040039196-A1 (2-Oxindol-3-ylidenyl) acetic acid derivatives and their use as protein kinase inhibitors MAPKAPK2, MAPKAPK3, MAP3K2 IDO1 1262/4885TDO2 1921/4885TDP1 2581/4885
US-20030216462-A1 (2-Oxindol-3-ylidenyl) acetic acid derivatives and their use as protein kinase inhibitors MAPKAPK2, MAPKAPK3, MAP3K2 IDO1 1262/4885TDO2 1921/4885TDP1 2581/4885

“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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