SCHEMBL9952138

SCHEMBL9952138

CN1C(=O)C(c2ccccc2)c2ccccc21

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 1/20 0.49
AURKA O14965 1/20 0.49
DAPK3 O43293 1/20 0.49
JAK2 O60674 1/20 0.49
PRKD3 O94806 1/20 0.49
MAP4K4 O95819 1/20 0.49
PAK4 O96013 1/20 0.49
ABL1 P00519 1/20 0.49
NTRK1 P04629 1/20 0.49
LCK P06239 1/20 0.49
FYN P06241 1/20 0.49
CSF1R P07333 1/20 0.49
RET P07949 1/20 0.49
IGF1R P08069 1/20 0.49
MET P08581 1/20 0.49
PDGFRB P09619 1/20 0.49
PIM1 P11309 1/20 0.49
FGFR1 P11362 1/20 0.49
PDGFRA P16234 1/20 0.49
PRKACA P17612 1/20 0.49

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
SCHEMBL29915854 1.00 CHEK1 (0.49) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL17583585 0.90 GABRP (0.44) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL29915935 0.88 MEN1 (0.52) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL23959070 0.86 MEN1 (0.44) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL28735590 0.86 MEN1 (0.46) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL23959045 0.86 RAB9A (0.46) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL6904077 0.84 CHEK1 (0.65) CHEK1AURKADAPK3JAK2PRKD3
SCHEMBL23959055 0.84 RAB9A (0.51) GAASMN1; SMN2MAPTALDH1A1KDM4E
SCHEMBL17583584 0.83 MEN1 (0.45) CHEK1AURKADAPK3JAK2PRKD3
Iodide SCHEMBL28598560 0.82 CHEK1 (0.62) CHEK1AURKADAPK3JAK2PRKD3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021212974-A1 RACEMIC AND CHIRAL 3-(2,3-BUTADIENYL)OXYINDOLINONE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 复旦大学 (CN) 2021-10-28 WO disclosed
CN-108440378-B Preparation method of iodine-hydrogen peroxide promoted 3-amino-2-indolone derivative at room temperature 宁波大学 2021-03-12 CN disclosed
CN-108409630-B Preparation method of 3-hydroxy-2-indolone derivative in aqueous phase 宁波大学 2021-01-15 CN disclosed
CN-108003086-B Preparation method of 3-amino-2-indolone compound 宁波大学 2020-08-14 CN disclosed
CN-107686460-B Preparation method of 3-substituted-3-hydroxy-2-indolone compound 宁波大学 2020-06-12 CN disclosed
CN-108409630-A preparation method of 3-hydroxy-2-indolone derivative in aqueous phase 宁波大学 2018-08-17 CN disclosed
CN-103380126-B Process for preparing 2- (triazinylcarbonyl) sulfonanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-01-20 CN disclosed
US-9096551-B2 Method for producing 2-(triazinylcarbonyl) sulfonanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-08-04 US disclosed
EP-2655346-B1 PROCESS FOR THE PREPARATION OF 2-(TRIAZINYLCARBONYL)SULFONANILIDES BAYER IP GMBH (DE) 2015-01-21 EP disclosed
US-20140024828-A1 Method for producing 2-(triazinylcarbonyl) sulfonanilides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-01-23 US disclosed
EP-2655346-A2 METHOD FOR PRODUCING 2-(TRIAZINYLCARBONYL) SULFONANILIDES Bayer Intellectual Property GmbH (DE) 2013-10-30 EP disclosed
CN-103380126-A Process for preparing 2- (triazinylcarbonyl) sulfonanilides BAYER IP GMBH 2013-10-30 CN disclosed
WO-2012084857-A2 METHOD FOR PRODUCING 2-(TRIAZINYLCARBONYL) SULFONANILIDES BAYER CROPSCIENCE AG (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-20140024828-A1 Method for producing 2-(triazinylcarbonyl) sulfonanilides AOX1, SULT1E1, CBR1 CHEK1 3766/4885AURKA 1561/4885DAPK3 4426/4885

“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.