SCHEMBL2670934

SCHEMBL2670934

c1cc(-c2nnco2)ccn1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 11/20 0.65
TP53 P04637 1/20 0.54
PKM P14618 1/20 0.54
KDM4E B2RXH2 2/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 2/20 0.52
TLR8 Q9NR97 1/20 0.52
MAPT P10636 1/20 0.52
HTT P42858 1/20 0.52
CDC7 O00311 1/20 0.50
DBF4 Q9UBU7 1/20 0.50
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
ATAD2 Q6PL18 1/20 0.47
HPGD P15428 1/20 0.46
MAPK1 P28482 1/20 0.46
TSHR P16473 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
SCHEMBL17694561 0.85 NOTUM (0.78) NOTUMTP53KDM4EALDH1A1LMNA
SCHEMBL2610163 0.83 NOTUM (0.75) NOTUMTP53KDM4EALDH1A1LMNA
SCHEMBL9555 0.79 NOTUM (1.00) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL21408738 0.78 NOTUM (0.55) NOTUMKDM4EALDH1A1LMNATLR8
Water SCHEMBL27542737 0.78 NOTUM (0.62) NOTUMTP53KDM4EALDH1A1LMNA
Biphenyl SCHEMBL22577775 0.77 NOTUM (0.95) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL3537328 0.76 NOTUM (1.00) NOTUMTP53KDM4EALDH1A1LMNA
SCHEMBL1033299 0.76 NOTUM (0.63) NOTUMKDM4EALDH1A1LMNATLR8
SCHEMBL860256 0.76 NOTUM (0.64) NOTUMTP53KDM4EALDH1A1LMNA
SCHEMBL5571187 0.76 NOTUM (0.91) NOTUMKDM4EALDH1A1LMNATLR8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116763814-A Preparation method of iron supplementing preparation and iron supplementing preparation 国家纳米科学中心 2023-09-19 CN claimed
CN-116769181-A Zinc-based molecular crystal blue-green light material and preparation method thereof 江西省科学院应用化学研究所 2023-09-19 CN claimed
CN-112830941-A Synthesis method of polyacid-based metal organic framework materials with different functionalities 东北师范大学 2021-05-25 CN claimed
CN-105251533-A Preparation of complex with pyridine oxadiazole and research of catalytic activity of complex UNIV QILU TECHNOLOGY 2016-01-20 CN claimed
CN-105175457-A Pyridine oxadiazole complex capable of catalyzing DHPMs (Dihydropyrimidinones) UNIV QILU TECHNOLOGY 2015-12-23 CN claimed
CN-105153240-A Research of pyridine oxadiazole complex in catalyzing dihydropyrimidones UNIV QILU TECHNOLOGY 2015-12-16 CN claimed
US-20140301999-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS DECODE GENETICS EHF (IS) 2014-10-09 US claimed
EP-2674417-A2 Biaryl PDE4 inhibitors for treating inflammation Decode Genetics EHF (IS) 2013-12-18 EP claimed
CN-103059049-A Pure red phosphorescent crystal material as well as preparation method and application thereof FUJIAN MATTER STRUCTURE 2013-04-24 CN claimed
US-20120213758-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS DeCODE Genetics enf (IS) 2012-08-23 US claimed
US-20120183522-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS DECODE GENETICS EHF (IS) 2012-07-19 US claimed
CN-102516984-A Orange-red phosphorescent crystal material, as well as preparation method and use thereof FUJIAN MATTER STRUCTURE 2012-06-27 CN claimed
EP-2222638-A2 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATION Decode Genetics EHF (IS) 2010-09-01 EP claimed
US-20090324569-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS DECODE GENETICS EHF (IS) 2009-12-31 US claimed
US-20090136473-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS DECODE GENETICS EHF (IS) 2009-05-28 US claimed
WO-2009067600-A2 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATION DECODE GENETICS EHF (IS) 2009-05-28 WO claimed
US-20020025477-A1 Non-aqueous electrolytic solution and secondary battery containing same MITSUBISHI CHEMICAL CORPORATION (JP) 2002-02-28 US claimed
EP-1172878-A2 Non-aqueous electrolytic solution and secondary battery containing same MITSUBISHI CHEMICAL CORPORATION (JP) 2002-01-16 EP claimed
CN-120048294-A Photopolymer holographic recording medium, preparation method and application thereof 珠海莫界科技有限公司 2025-05-27 CN disclosed
US-4051099-A ISOINDOLES CIBA-GEIGY CORPORATION (US) 1977-09-27 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 (5 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-20090136473-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS PDE4A, PDE4B, PDE3B NOTUM 1776/4885TP53 3957/4885PKM 1085/4885
US-20120183522-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS PDE4A, PDE4B, PDE3B NOTUM 1460/4885TP53 4860/4885PKM 1344/4885
US-20140301999-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS PDE4A, PDE4B, PDE3B NOTUM 1460/4885TP53 4860/4885PKM 1344/4885
US-20120213758-A1 BIARYL PDE4 INHIBITORS FOR TREATING PULMONARY AND CARDIOVASCULAR DISORDERS PDE4A, PDE4B, PDE3B NOTUM 1776/4885TP53 3957/4885PKM 1085/4885
US-20090324569-A1 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATORY, CARDIOVASCULAR AND CNS DISORDERS PDE4A, PDE4B, PDE3B NOTUM 1460/4885TP53 4860/4885PKM 1344/4885

“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.