SCHEMBL434975

SCHEMBL434975

Cc1ccc2nc(C)c(C)nc2c1

nearest known ligand 0.70

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 1/20 0.70
KDM4E B2RXH2 4/20 0.67
MAPT P10636 2/20 0.67
ALDH1A1 P00352 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
TDP1 Q9NUW8 2/20 0.55
CYP1A2 P05177 3/20 0.50
RAB9A P51151 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
PSMB5 P28074 1/20 0.47
NPC1 O15118 1/20 0.46
CYP2A6 P11509 1/20 0.46
NCK1 P16333 1/20 0.45
BACE1 P56817 1/20 0.45

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
SCHEMBL30745612 1.00 NQO2 (0.70) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL9927345 0.89 NQO2 (0.85) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL2756741 0.89 NQO2 (0.85) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL21131352 0.86 NQO2 (0.81) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL18511341 0.86 NQO2 (0.59) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL15383508 0.84 KDM4E (0.61) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL14764615 0.84 NQO2 (0.57) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL18873137 0.84 NQO2 (0.57) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL14764426 0.84 NQO2 (0.57) NQO2KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL28286262 0.84 NQO2 (0.57) NQO2KDM4EMAPTALDH1A1L3MBTL1

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 198 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117567372-A Piperidine oxidation free radical derivative, preparation method and application thereof in flow battery 合肥工业大学 2024-02-20 CN claimed
EP-2119717-B1 8-[3-amino-piperidin-1-yl]-xanthins, their production and utilisation as DPP IV inhibitors BOEHRINGER INGELHEIM INT (DE) 2018-01-17 EP claimed
US-8697868-B2 8-[3-amino-piperidin-1-yl]-xanthines, their preparation and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-04-15 US claimed
US-7645763-B2 dipeptidylpeptidase-IV inhibitors; antidiabetic agents, antiarthritic agents, obesity, allograft transplantation, and osteoporosis caused by calcitonin; 1,3-disubstituted-7-(2-butyn-1-yl)-8-(3-aminopiperidin-1-yl)-xanthine compounds BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2010-01-12 US claimed
US-20090137801-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-28 US claimed
EP-1758905-B1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINE, THE PRODUCTION THEREOF AND THE USE IN THE FORM OF A DDP-IV INHIBITOR BOEHRINGER INGELHEIM INT (DE) 2009-04-29 EP claimed
EP-1720875-B1 8- [3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF, AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM INT (DE) 2008-12-10 EP claimed
US-20050234108-A1 8-[3-amino-piperidin-1-yl]-xanthines, their preparation and their use as pharmaceutical compositions BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-10-20 US claimed
US-20050187227-A1 8-[3-Amino-piperidin-1-yl]-xanthines, their preparation and their use as pharmaceutical composition BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-08-25 US claimed
EP-0517989-B1 Bleach bath and its use in a silver dye bleaching process JAHLEEL CORP (PA) 1998-03-18 EP claimed
EP-0014688-B1 PROCESS FOR THE TREATMENT OF SILVER DYE-BLEACHING MATERIALS, AQUEOUS PREPARATION THEREFOR, CONCENTRATE AND PROCESS FOR MAKING THE PREPARATION CIBA-GEIGY AG (CH) 1983-03-23 EP claimed
US-4304846-A USING MIXTURES OF A 1,4- OR 1,2-DIAZINE AS BLEACHING CATALYSTS; PREFERENTIAL REDOX POTENTIALS CIBA-GEIGY AG (CH) 1981-12-08 US claimed
EP-0014688-A2 Process for the treatment of silver dye-bleaching materials, aqueous preparation therefor, concentrate and process for making the preparation CIBA-GEIGY AG (CH) 1980-08-20 EP claimed
WO-2025215566-A1 NON-AQUEOUS REDOX FLOW BATTERIES ENI S.P.A. (IT) 2025-10-16 WO disclosed
US-20240133963-A1 FLOW BATTERY CAMBRIDGE ENTERPRISE LIMITED (GB) 2024-04-25 US disclosed
CN-117567372-A Piperidine oxidation free radical derivative, preparation method and application thereof in flow battery 合肥工业大学 2024-02-20 CN disclosed
US-4197123-A SUBTRACTIVE CIBA-GEIGY AG (CH) 1980-04-08 US disclosed
US-4186008-A STRONG ACID, WATER-SOLUBLE IODIDE, NON-QUATERNIZED QUINOXALINE OR PYRAZINE, ANIT-OXIDANT, QUATERNARY AMMONIUM SALT OF AMINE SALT CIBA-GEIGY AKTIENGESELLSCHAFT (CH) 1980-01-29 US disclosed
US-4046566-A PROCESS FOR THE PRODUCTION OF MASKED POSITIVE COLOR IMAGES BY THE SILVER DYE BLEACH PROCESS USING SILVER COMPLEX DIFFUSION CIBA-GEIGY AG (CH) 1977-09-06 US disclosed
US-4014698-A ACIDS, IODIDE COMPOUNDS, OXIDIZERS, DIAZINE COMPOUND CIBA-GEIGY AG (CH) 1977-03-29 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-20090137801-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS DPP8, DPP4, DPP7 NQO2 956/4885KDM4E 1036/4885MAPT 295/4885
US-20050234108-A1 8-[3-amino-piperidin-1-yl]-xanthines, their preparation and their use as pharmaceutical compositions DPP8, DPP4, DPP7 NQO2 947/4885KDM4E 1140/4885MAPT 330/4885
US-20050187227-A1 8-[3-Amino-piperidin-1-yl]-xanthines, their preparation and their use as pharmaceutical composition DPP8, DPP4, DPP7 NQO2 821/4885KDM4E 1025/4885MAPT 340/4885

“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.