SCHEMBL2270788

SCHEMBL2270788

CCCCC1CCC(C2CCC(C3CC(=O)O3)CC2)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.47
NAAA Q02083 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
MAPT P10636 1/20 0.36
PPARG P37231 1/20 0.36
TLR4 O00206 2/20 0.34
AKT1 P31749 2/20 0.34
PKM P14618 1/20 0.34
CCR2 P41597 1/20 0.34

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
SCHEMBL2270785 1.00 CYP1A2 (0.47) CYP1A2NAAAPOLBHPGDLMNA
SCHEMBL15086803 0.95 CYP1A2 (0.54) CYP1A2NAAAHTTMAPTPPARG
SCHEMBL2273086 0.95 CYP1A2 (0.54) CYP1A2NAAAHTTMAPTPPARG
SCHEMBL2270903 0.95 CYP1A2 (0.54) CYP1A2NAAAHTTMAPTPPARG
SCHEMBL2273082 0.95 CYP1A2 (0.54) CYP1A2NAAAHTTMAPTPPARG
SCHEMBL2277253 0.95 CYP1A2 (0.54) CYP1A2NAAAHTTMAPTPPARG
SCHEMBL2270910 0.95 CYP1A2 (0.54) CYP1A2NAAAHTTMAPTPPARG
SCHEMBL12370935 0.93 CYP1A2 (0.53) CYP1A2HTTPPARGPKMCCR2
SCHEMBL2273782 0.91 CYP1A2 (0.41) CYP1A2NAAALMNAMAPTPPARG
SCHEMBL2277758 0.91 CYP1A2 (0.41) CYP1A2NAAALMNAMAPTPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2020407-B1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF JNC CORP (JP) 2013-07-03 EP claimed
CN-101490026-B 2-oxetanone derivative and process for production thereof CHISSO CORP 2012-11-21 CN claimed
US-7999123-B2 2-oxetanone derivative and process for production thereof JNC CORPORATION (JP) 2011-08-16 US claimed
US-20090275756-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF CHISSO CORPORATION (JP) 2009-11-05 US claimed
CN-101490026-A 2-oxetanone derivative and process for production thereof CHISSO CORP (JP) 2009-07-22 CN claimed
EP-2020407-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF Chisso Corporation (JP) 2009-02-04 EP claimed
EP-2020407-B1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF JNC CORP (JP) 2013-07-03 EP disclosed
CN-101490026-B 2-oxetanone derivative and process for production thereof CHISSO CORP 2012-11-21 CN disclosed
US-7999123-B2 2-oxetanone derivative and process for production thereof JNC CORPORATION (JP) 2011-08-16 US disclosed
US-20090275756-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF CHISSO CORPORATION (JP) 2009-11-05 US disclosed
CN-101490026-A 2-oxetanone derivative and process for production thereof CHISSO CORP (JP) 2009-07-22 CN disclosed
EP-2020407-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF Chisso Corporation (JP) 2009-02-04 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 (1 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-20090275756-A1 2-OXETANONE DERIVATIVE AND PROCESS FOR PRODUCTION THEREOF OGDH, OXGR1, OXER1 CYP1A2 40/4885NAAA 3308/4885POLB 3264/4885

“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.