SCHEMBL637552

SCHEMBL637552

Cc1ncnc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.56
PI4K2B Q8TCG2 1/20 0.56
PI4K2A Q9BTU6 1/20 0.56
PI4KB Q9UBF8 1/20 0.56
PDE4A P27815 1/20 0.56
PDE4B Q07343 1/20 0.56
PDE4C Q08493 1/20 0.56
PDE4D Q08499 1/20 0.56
ADORA2A P29274 2/20 0.52
NPC1 O15118 1/20 0.49
POLB P06746 1/20 0.49
MAPK1 P28482 1/20 0.49
RAB9A P51151 1/20 0.49
EGFR P00533 3/20 0.48
LMNA P02545 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
DAPK3 O43293 1/20 0.47
MAP4K4 O95819 1/20 0.47
ABL1 P00519 1/20 0.47
ERBB2 P04626 1/20 0.47

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
Benzene SCHEMBL27304475 0.98 ADORA2A (0.55) PI4KAPI4K2BPI4K2API4KBPDE4A
Ethane SCHEMBL27889933 0.98 PI4KA (0.54) PI4KAPI4K2BPI4K2API4KBPDE4A
Hydrazine SCHEMBL27389392 0.96 PI4KA (0.57) PI4KAPI4K2BPI4K2API4KBPDE4A
Hexane SCHEMBL27871520 0.88 SMN1; SMN2 (0.58) PI4KAPI4K2BPI4K2API4KBPDE4A
Chlorobenzene SCHEMBL27871510 0.88 PDE4A (0.55) PI4KAPI4K2BPI4K2API4KBPDE4A
Heptane SCHEMBL27871641 0.87 SMN1; SMN2 (0.60) PI4KAPI4K2BPI4K2API4KBPDE4A
Hydrochloric Acid SCHEMBL14830202 0.85 ADORA2A (0.44) PI4KAPI4K2BPI4K2API4KBPDE4A
Trifluoromethanesulfonic Acid SCHEMBL28146709 0.81 PKM (0.43) PI4KAPI4K2BPI4K2API4KBPDE4A
SCHEMBL24183832 0.80 TLR7 (0.43) PI4KAPI4K2BPI4K2API4KBPDE4A
SCHEMBL3075421 0.75 ADORA2A (0.75) PI4KAPI4K2BPI4K2API4KBPDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4727445-A1 INFECTION-SENSING MEDICAL SYSTEMS AND METHODS Bard Access Systems, Inc. (US) 2026-04-22 EP claimed
WO-2025149628-A1 PIPERIDINE DERIVATIVES AS INHIBITORS OF NICOTINAMIDE N-METHYL TRANSFERASE ASTRAZENECA AB (SE) 2025-07-17 WO claimed
WO-2025019242-A1 INFECTION-SENSING MEDICAL SYSTEMS AND METHODS BARD ACCESS SYSTEMS, INC. (US) 2025-01-23 WO claimed
EP-4275042-A1 DETECTION OF RESPIRATORY TRACT INFECTIONS (RTIS) Nanose Medical Ltd (IL) 2023-11-15 EP claimed
US-20220378797-A1 DPP-IV INHIBITOR COMBINED WITH A FURTHER ANTIDIABETIC AGENT, TABLETS COMPRISING SUCH FORMULATIONS, THEIR USE AND PROCESS FOR THEIR PREPARATION BOEHRINGER INGELHEIM INT (DE) 2022-12-01 US claimed
WO-2022149132-A1 DETECTION OF RESPIRATORY TRACT INFECTIONS (RTIS) NANOSE MEDICAL LTD (IL) 2022-07-14 WO claimed
US-20220104465-A1 TREATMENT RESERVOIRS AND SYSTEMS FOR CONTROLLED RELEASE OF A TREATMENT COMPOUND IN AN AQUATIC ENVIRONMENT W. L. GORE & ASSOCIATES, INC. 2022-04-07 US claimed
EP-3923711-A1 TREATMENT RESERVOIRS AND SYSTEMS FOR CONTROLLED RELEASE OF A TREATMENT COMPOUND IN AN AQUATIC ENVIRONMENT W. L. Gore & Associates, Inc. (US) 2021-12-22 EP claimed
CN-113766830-A Treatment reservoir and system for controlled release of treatment compounds in aquatic environments W.L.戈尔及同仁股份有限公司 2021-12-07 CN claimed
WO-2020168095-A1 TREATMENT RESERVOIRS AND SYSTEMS FOR CONTROLLED RELEASE OF A TREATMENT COMPOUND IN AN AQUATIC ENVIRONMENT W. L. GORE & ASSOCIATES, INC. (US) 2020-08-20 WO claimed
EP-2190434-A2 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES Boehringer Ingelheim International GmbH (DE) 2010-06-02 EP claimed
EP-1532149-B1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PRODUCTION THEREOF AND THE USE OF THE SAME AS MEDICAMENTS BOEHRINGER INGELHEIM PHARMA (DE) 2009-12-30 EP claimed
EP-2091929-A1 AGENTS THAT DISRUPT CELLULAR REPLICATION AND THEIR USE IN INHIBITING PATHOLOGICAL CONDITIONS The European Molecular Biology Laboratory (DE) 2009-08-26 EP claimed
WO-2009024542-A2 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-26 WO claimed
US-20080255159-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PREPARATION THEREOF AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM PHARMA KG (DE) 2008-10-16 US claimed
US-20080249089-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PREPARATION THEREOF AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM PHARMA KG (DE) 2008-10-09 US claimed
WO-2007107352-A1 AGENTS THAT DISRUPT CELLULAR REPLICATION AND THEIR USE IN INHIBITING PATHOLOGICAL CONDITIONS THE EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2007-09-27 WO claimed
US-20040097510-A1 8-[3-amino-piperidin-1-yl]-xanthines, the preparation thereof and their use as pharmaceutical compositions BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-05-20 US claimed
EP-0337308-B1 2-Pyridylmethylthio derivatives and antiulcer agents NISSHIN FLOUR MILLING CO (JP) 1994-11-30 EP claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 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-20080255159-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PREPARATION THEREOF AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS DPP8, DPP4, DPP3 PI4KA 1546/4885PI4K2B 2905/4885PI4K2A 3134/4885
US-20080249089-A1 8-[3-AMINO-PIPERIDIN-1-YL]-XANTHINES, THE PREPARATION THEREOF AND THEIR USE AS PHARMACEUTICAL COMPOSITIONS DPP8, DPP4, DPP3 PI4KA 1546/4885PI4K2B 2905/4885PI4K2A 3134/4885
US-20220378797-A1 DPP-IV INHIBITOR COMBINED WITH A FURTHER ANTIDIABETIC AGENT, TABLETS COMPRISING SUCH FORMULATIONS, THEIR USE AND PROCESS FOR THEIR PREPARATION DPP4, DPP3, DPP7 PI4KA 329/4885PI4K2B 711/4885PI4K2A 790/4885
US-20040097510-A1 8-[3-amino-piperidin-1-yl]-xanthines, the preparation thereof and their use as pharmaceutical compositions DPP8, DPP4, DPP3 PI4KA 918/4885PI4K2B 1600/4885PI4K2A 1833/4885

“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.