SCHEMBL1249532

SCHEMBL1249532

NCCNCC1CCOC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.36
NAMPT P43490 4/20 0.35
CA12 O43570 3/20 0.35
CA6 P23280 3/20 0.35
CA7 P43166 3/20 0.35
CA9 Q16790 3/20 0.35
CA14 Q9ULX7 3/20 0.35
CA5B Q9Y2D0 3/20 0.35
MEN1 O00255 1/20 0.35
RECQL P46063 1/20 0.35
KMT2A Q03164 1/20 0.35
SAT1 P21673 1/20 0.34
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
MAP4K4 O95819 2/20 0.34
LMNA P02545 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
CA2 P00918 2/20 0.33
CA3 P07451 2/20 0.33

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
SCHEMBL8834672 0.92 CASP2 (0.38) DRD4NAMPTCA12CA6CA7
SCHEMBL6929311 0.83 DRD4 (0.38) DRD4NAMPTMAP4K4PDCD1CD274
SCHEMBL5324869 0.80 SAT1 (0.38) DRD4NAMPTSAT1GNAI3GNAO1
SCHEMBL23219671 0.78 GNAI3 (0.54) NAMPTSAT1GNAI3GNAO1GNAI1
SCHEMBL22481630 0.76 EGLN2 (0.34) DRD4NAMPTMAP4K4
SCHEMBL18575576 0.75 SAT1 (0.54) CA12CA6CA7CA9CA14
SCHEMBL4524938 0.75
SCHEMBL8551637 0.75
SCHEMBL17288790 0.74
SCHEMBL5673317 0.72

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210277175-A1 AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2021-09-09 US disclosed
US-11046809-B2 Amine for low-emission epoxy resin compositions SIKA TECHNOLOGY AG (CH) 2021-06-29 US disclosed
EP-3350245-B1 AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS SIKA TECH AG (CH) 2019-08-14 EP disclosed
US-20190002628-A1 AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS SIKA TECHNOLOGY AG (CH) 2019-01-03 US disclosed
EP-3144335-A1 AMINE FOR LOW-EMISSION EPOXY RESIN COMPOSITIONS Sika Technology AG (CH) 2017-03-22 EP disclosed
EP-2281812-B1 NITROGENOUS HETEROCYCLIC COMPOUND WITH INSECTICIDAL ACTIVITY AND ITS PREPARATION AND USE UNIV EAST CHINA SCIENCE & TECH (CN) 2014-01-22 EP disclosed
EP-2281812-B1 NITROGENOUS HETEROCYCLIC COMPOUND WITH INSECTICIDAL ACTIVITY AND ITS PREPARATION AND USE UNIV EAST CHINA SCIENCE & TECH (CN) 2014-01-22 EP disclosed
US-8232407-B2 Nitrogenous heterocyclic compounds with insecticidal activity, and the preparation and use thereof EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2012-07-31 US disclosed
US-8232407-B2 Nitrogenous heterocyclic compounds with insecticidal activity, and the preparation and use thereof EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2012-07-31 US disclosed
US-8232407-B2 Nitrogenous heterocyclic compounds with insecticidal activity, and the preparation and use thereof EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2012-07-31 US disclosed
EP-2281812-A1 NITROGENOUS HETEROCYCLIC COMPOUND WITH INSECTICIDAL ACTIVITY AND ITS PREPARATION AND USE East China University of Science and Technology (CN) 2011-02-09 EP disclosed
EP-2281812-A1 NITROGENOUS HETEROCYCLIC COMPOUND WITH INSECTICIDAL ACTIVITY AND ITS PREPARATION AND USE East China University of Science and Technology (CN) 2011-02-09 EP disclosed
US-20100298346-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS WITH INSECTICIDAL ACTIVITY, AND THE PREPARATION AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2010-11-25 US disclosed
US-20100298346-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS WITH INSECTICIDAL ACTIVITY, AND THE PREPARATION AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2010-11-25 US disclosed
US-20100298346-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS WITH INSECTICIDAL ACTIVITY, AND THE PREPARATION AND USE THEREOF EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2010-11-25 US disclosed
US-7655665-B2 Nitromethylene derivatives and their use EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2010-02-02 US disclosed
US-7655665-B2 Nitromethylene derivatives and their use EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2010-02-02 US disclosed
US-20070281950-A1 NITROMETHYLENE DERIVATIVES AND THEIR USE EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2007-12-06 US disclosed
US-20070281950-A1 NITROMETHYLENE DERIVATIVES AND THEIR USE EAST CHINA UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2007-12-06 US disclosed
EP-1826209-A1 NITROMETHYLENE DERIVATIVES AND THEIR USE East China University of Science and Technology (CN) 2007-08-29 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 (2 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-20100298346-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS WITH INSECTICIDAL ACTIVITY, AND THE PREPARATION AND USE THEREOF NIT2, NOS2, NOS3 DRD4 637/4885NAMPT 170/4885CA12 1851/4885
US-20070281950-A1 NITROMETHYLENE DERIVATIVES AND THEIR USE L3MBTL4, L3MBTL1, NNMT DRD4 1172/4885NAMPT 392/4885CA12 4827/4885

“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.