SCHEMBL1927666

SCHEMBL1927666

COC(=O)[CH]C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40
NPSR1 Q6W5P4 1/20 0.38
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
EPHX2 P34913 3/20 0.35
EPHX1 P07099 6/20 0.34
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
MAPT P10636 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
CYP3A4 P08684 1/20 0.34
HDAC8 Q9BY41 1/20 0.33
HDAC6 Q9UBN7 1/20 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
SCHEMBL1928325 0.98 HCAR2 (0.42) HCAR2KEAP1NFE2L2NPSR1MEN1
SCHEMBL1928674 0.93
SCHEMBL7218326 0.88
SCHEMBL9064096 0.78 HCAR2 (0.48) HCAR2KEAP1NFE2L2NPSR1SMN1; SMN2
SCHEMBL9129957 0.78 HCAR2 (0.48) HCAR2KEAP1NFE2L2NPSR1SMN1; SMN2
SCHEMBL5608734 0.78 HCAR2 (0.48) HCAR2KEAP1NFE2L2NPSR1SMN1; SMN2
SCHEMBL9129967 0.78 HCAR2 (0.48) HCAR2KEAP1NFE2L2NPSR1SMN1; SMN2
SCHEMBL8896239 0.77 ALDH1A1 (0.42) HCAR2NPSR1MEN1KMT2AALDH1A1
SCHEMBL9540359 0.77 ALDH1A1 (0.42) HCAR2NPSR1MEN1KMT2AALDH1A1
SCHEMBL38251 0.76 HCAR2 (0.50) HCAR2KEAP1NFE2L2NPSR1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003699-B2 Amide compound and use thereof for controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-08-23 US disclosed
US-7956010-B2 Amide compound and use thereof for controlling plant diseases SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-06-07 US disclosed
EP-2240020-A1 INTRATHECAL TREATMENT OF NEUROPATHIC PAIN WITH A2AR AGONISTS Pgx Health, Llc (US) 2010-10-20 EP disclosed
US-20100105647-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED 2010-04-29 US disclosed
US-20100048701-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-25 US disclosed
EP-2154124-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed
EP-2151432-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES Sumitomo Chemical Company, Limited (JP) 2010-02-10 EP disclosed
WO-2009089425-A1 INTRATHECAL TREATMENT OF NEUROPATHIC PAIN WITH A2AR AGONISTS PGXHEALTH LLC (US) 2009-07-16 WO disclosed
WO-2007120972-A2 METHOD TO TREAT SICKLE CELL DISEASE UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2007-10-25 WO disclosed
EP-0564960-A1 Imidazopyridines as angiotensin II antagonists MERCK PATENT GmbH (DE) 1993-10-13 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-20100048701-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES CYC1, CBR3, CBR1 HCAR2 581/4885KEAP1 392/4885NFE2L2 237/4885
US-20100105647-A1 AMIDE COMPOUND AND USE THEREOF FOR CONTROLLING PLANT DISEASES CYC1, CBR3, CBR1 HCAR2 854/4885KEAP1 605/4885NFE2L2 438/4885

“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.