SCHEMBL497831

SCHEMBL497831

[CH2]CCCCC(=O)NCCC

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FAAH O00519 6/20 0.53
CNR1 P21554 3/20 0.50
DNM1 Q05193 2/20 0.50
CASP2 P42575 1/20 0.48
NAAA Q02083 1/20 0.46
MCL1 Q07820 1/20 0.44
EPHX2 P34913 3/20 0.44
SELP P16109 1/20 0.44
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
TRPV1 Q8NER1 1/20 0.42
CNR2 P34972 1/20 0.42

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
SCHEMBL7557291 0.98 FAAH (0.56) FAAHCNR1DNM1CASP2NAAA
SCHEMBL5542615 0.98 FAAH (0.56) FAAHCNR1DNM1CASP2NAAA
SCHEMBL5537118 0.94 CNR1 (0.51) FAAHCNR1DNM1CASP2NAAA
SCHEMBL5536463 0.90 FAAH (0.59) FAAHCNR1DNM1CASP2NAAA
SCHEMBL16302656 0.89 FAAH (0.63) FAAHCNR1DNM1CASP2NAAA
SCHEMBL7346940 0.88 CASP2 (0.66) FAAHCNR1DNM1CASP2NAAA
SCHEMBL7552938 0.88 FAAH (0.62) FAAHCNR1DNM1CASP2NAAA
SCHEMBL5544292 0.88 FAAH (0.62) FAAHCNR1DNM1CASP2NAAA
SCHEMBL3033459 0.88 CASP2 (0.66) FAAHCNR1DNM1CASP2NAAA
SCHEMBL5541786 0.86 CASP2 (0.69) FAAHDNM1CASP2NAAAEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2157084-B1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA CO (JP) 2013-05-22 EP disclosed
EP-2570418-A2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles compound OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-03-20 EP disclosed
EP-1555267-B1 2,3-DIHYDRO-6-NITROIMIDAZO[2,1-b]OXAZOLES OTSUKA PHARMA CO LTD (JP) 2013-01-16 EP disclosed
US-8106053-B2 5-phenyl-3-pyridazinone derivative KOWA COMPANY, LTD. 2012-01-31 US disclosed
US-20100324091-A1 Pyrazolone Derivative KOWA COMPANY, LTD. (JP) 2010-12-23 US disclosed
US-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE KOWA COMPANY, LTD. (JP) 2010-08-05 US disclosed
EP-2172458-A1 PYRAZOLONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-04-07 EP disclosed
EP-2157084-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE Kowa Company, Ltd. (JP) 2010-02-24 EP disclosed
US-7262212-B2 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-08-28 US disclosed
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2006-05-04 US disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 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 (3 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 FAAH 4363/4885CNR1 857/4885DNM1 1442/4885
US-20100197698-A1 5-PHENYL-3-PYRIDAZINONE DERIVATIVE SERPINE1, MMP1, PLAT FAAH 2721/4885CNR1 2492/4885DNM1 3527/4885
US-20100324091-A1 Pyrazolone Derivative SERPINE1, SERPINC1, TFPI FAAH 1662/4885CNR1 1478/4885DNM1 3208/4885

“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.