SCHEMBL4850477

SCHEMBL4850477

COC(=O)C1C(=O)Nc2ccc(F)cc21

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.44
KMT2A Q03164 4/20 0.39
HTR7 P34969 2/20 0.39
ALDH1A1 P00352 2/20 0.38
KDM4E B2RXH2 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 3/20 0.37
DRD2 P14416 1/20 0.37
DRD1 P21728 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
ADRA1A P35348 1/20 0.37
HTR6 P50406 1/20 0.37
POLB P06746 2/20 0.37
TP53 P04637 1/20 0.37
TGM2 P21980 1/20 0.37
KDR P35968 1/20 0.37
MAOB P27338 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
SCHEMBL4270503 0.82 TP53 (0.45) MAPTKMT2AALDH1A1KDM4EMEN1
SCHEMBL9833467 0.82 CDYL2 (0.48) KMT2AMEN1TP53TGM2
SCHEMBL5259073 0.81 MAPT (0.45) MAPTKMT2AHTR7ALDH1A1MEN1
SCHEMBL5739849 0.79 MAPT (0.44) MAPTKMT2AHTR7ALDH1A1KDM4E
SCHEMBL7681777 0.78 MAPT (0.58) MAPTKMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL9830748 0.76 ALDH1A1 (0.34) MAPTKMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL9834567 0.75 ALDH1A1 (0.35) MAPTKMT2AALDH1A1KDM4EL3MBTL1
SCHEMBL9672933 0.74 ALPL (0.39) KMT2AMEN1
SCHEMBL10545893 0.74 TP53 (0.47) MAPTKMT2AHTR7MEN1DRD2
SCHEMBL15075740 0.73 ALDH1A1 (0.43) MAPTKMT2AALDH1A1KDM4EMEN1

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
CN-112079764-B Synthesis method of sunitinib intermediate 5-fluoroindol-2-one 山东汇海医药化工有限公司 2023-08-01 CN disclosed
CN-112079764-A Synthesis method of sunitinib intermediate 5-fluoroindole-2-ketone 山东汇海医药化工有限公司 2020-12-15 CN disclosed
CN-100562319-C 2-cyanopyrrole and pyrimidine and its pharmaceutical use NOVARTIS AG (CH) 2009-11-25 CN disclosed
US-7342040-B2 5-fluorooxindole-3-carboxylic acid ester UBE INDUSTRIES, LTD. (JP) 2008-03-11 US disclosed
EP-1592426-B1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2007-12-19 EP disclosed
US-20060247251-A1 2-Cyanopyrrolopyrimidines and pharmaceutical uses thereof NOVARTIS AG (CH) 2006-11-02 US disclosed
CN-1756553-A 2-cyanopyrrolopyrimidines and pharmaceutical uses thereof NOVARTIS AG (CH) 2006-04-05 CN disclosed
EP-1592426-A1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF Novartis AG (CH) 2005-11-09 EP disclosed
US-20050182123-A1 5-Fluorooxindole-3-carboxylic acid ester UBE INDUSTRIES, LTD. (JP) 2005-08-18 US disclosed
US-6900335-B2 Process for producing 5-fluorooxindole and for producing intermediates therefor UBE INDUSTRIES, LTD. (JP) 2005-05-31 US disclosed
WO-2004069256-A1 2-CYANOPYRROLOPYRIMIDINES AND PHARMACEUTICAL USES THEREOF NOVARTIS AG (CH) 2004-08-19 WO disclosed
US-20030181731-A1 Process for producing 5-fluorooxyindole and for producing intermediates therefor UBE INDUSTRIES., LTD (JP) 2003-09-25 US disclosed
EP-1310486-A1 PROCESS FOR PRODUCING 5-FLUOROOXYINDOLE AND FOR PRODUCING INTERMEDIATE THEREFOR Ube Industries, Ltd. (JP) 2003-05-14 EP 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-20060247251-A1 2-Cyanopyrrolopyrimidines and pharmaceutical uses thereof DPYD, P2RY1, P2RY2 MAPT 2788/4885KMT2A 3122/4885HTR7 3220/4885
US-20050182123-A1 5-Fluorooxindole-3-carboxylic acid ester CYP4F2, AKR7A2, CYP2F1 MAPT 4521/4885KMT2A 3962/4885HTR7 411/4885
US-20030181731-A1 Process for producing 5-fluorooxyindole and for producing intermediates therefor FAR1, CYP4F11, FDPS MAPT 4135/4885KMT2A 3653/4885HTR7 382/4885

“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.