SCHEMBL1624547

SCHEMBL1624547

CC1(C)COC(c2cccc(Br)c2)=N1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.54
HRH3 Q9Y5N1 2/20 0.51
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
IL2 P60568 1/20 0.41
HPGD P15428 1/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP2D6 P10635 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
ROCK1 Q13464 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39

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
SCHEMBL471881 0.88 KDM4E (0.62) KDM4EHRH3MAPTLMNAHTT
SCHEMBL11493291 0.87 KDM4E (0.48) KDM4EHRH3MAPTLMNAHTT
SCHEMBL20410843 0.85 KDM4E (0.59) KDM4EHRH3MAPTLMNAHTT
SCHEMBL30863841 0.82 KDM4E (0.56) KDM4EHRH3MAPTLMNAHTT
SCHEMBL1338857 0.82 KDM4E (0.56) KDM4EHRH3MAPTLMNAHTT
SCHEMBL4027768 0.81 LMNA (0.48) KDM4EHRH3MAPTLMNAHTT
SCHEMBL20410959 0.81 KDM4E (0.58) KDM4EHRH3MAPTLMNAHTT
SCHEMBL20410735 0.81 KDM4E (0.54) KDM4EHRH3MAPTLMNAHTT
SCHEMBL8491691 0.81 HPGD (0.55) KDM4EHRH3MAPTLMNAHTT
SCHEMBL3750225 0.81 KDM4E (0.54) KDM4EHRH3MAPTLMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021262548-A1 A PLATFORM FOR SCREENING NAD+ BINDING PROTEINS IN A CELLULAR CONTEXT OREGON HEALTH & SCIENCE UNIVERSITY (US) 2021-12-30 WO disclosed
US-20170066717-A1 NEW PHENYLAZETIDINECARBOXYLATE OR -CARBOXAMIDE COMPOUNDS INVENTIVA (FR) 2017-03-09 US disclosed
EP-3107910-A1 NEW PHENYLAZETIDINE, CARBOXYLATE OR CARBOXAMIDE COMPOUNDS INVENTIVA (FR) 2016-12-28 EP disclosed
WO-2015124868-A1 NEW PHENYLAZETIDINE, CARBOXYLATE OR CARBOXAMIDE COMPOUNDS INVENTIVA (FR) 2015-08-27 WO disclosed
US-7928129-B1 Nanomolar β-lactamase inhibitors NORTHWESTERN UNIVERSITY (US) 2011-04-19 US disclosed
US-7928129-B1 Nanomolar β-lactamase inhibitors NORTHWESTERN UNIVERSITY (US) 2011-04-19 US disclosed
US-7928129-B1 Nanomolar β-lactamase inhibitors NORTHWESTERN UNIVERSITY (US) 2011-04-19 US disclosed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
US-20070265256-A1 Phosphodiesterase 10 inhibitors AMGEN INC. 2007-11-15 US disclosed
US-7271186-B1 Nanomolar β-lactamase inhibitors NORTHWESTERN UNIVERSITY (US) 2007-09-18 US disclosed
EP-0063374-B1 SUBSTITUTED BIPHENYL COMPOUNDS FMC Corporation (US) 1984-02-22 EP disclosed
US-4402973-A Insecticidal (1,1'-biphenyl)-3-ylmethyl esters FMC CORPORATION (US) 1983-09-06 US disclosed
EP-0020685-B1 INSECTICIDAL CYCLOPROPANECARBOXYLATES FROM SUBSTITUTED (1,1'-BIPHENYL)-3-YLMETHYL COMPOUNDS FMC Corporation (US) 1983-06-15 EP disclosed
EP-0063374-A1 Substituted biphenyl compounds FMC Corporation (US) 1982-10-27 EP disclosed
US-4329518-A INSECTICIDES, ACARICIDES, MITICIDES FMC CORPORATION (US) 1982-05-11 US disclosed
EP-0049977-A1 Insecticidal (1,1'-biphenyl)-3-ylmethyl esters, their production and use and compositions containing them FMC Corporation (US) 1982-04-21 EP disclosed
EP-0020685-A4 INSECTICIDAL CYCLOPROPANECARBOXYLATES FROM SUBSTITUTED (1,1'-BIPHENYL)-3-YLMETHYL COMPOUNDS. FMC CORP (US) 1981-07-16 EP disclosed
EP-0020685-A1 INSECTICIDAL CYCLOPROPANECARBOXYLATES FROM SUBSTITUTED (1,1'-BIPHENYL)-3-YLMETHYL COMPOUNDS. FMC CORP (US) 1981-01-07 EP disclosed
US-4214004-A MITICIDES FMC CORPORATION (US) 1980-07-22 US disclosed
WO-1980001163-A1 INSECTICIDAL CYCLOPROPANECARBOXYLATES FROM SUBSTITUTED(1,1'-BIPHENYL)-3-YLMETHYL COMPOUNDS FMC CORP (US) 1980-06-12 WO 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-20170066717-A1 NEW PHENYLAZETIDINECARBOXYLATE OR -CARBOXAMIDE COMPOUNDS NCOR1, NCOR2, NCOA1 KDM4E 517/4885HRH3 541/4885MAPT 2804/4885
US-20070265256-A1 Phosphodiesterase 10 inhibitors PDE7A, PDE7B, PDE10A KDM4E 2328/4885HRH3 4562/4885MAPT 3278/4885

“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.