SCHEMBL5543381

SCHEMBL5543381

[CH2]CCCCCc1cccc(-c2ccccc2)c1

nearest known ligand 0.50

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AGXT P21549 1/20 0.50
IGF1R P08069 1/20 0.42
ALOX15 P16050 1/20 0.42
CHRNA7 P36544 2/20 0.41
CHRNA10 Q9GZZ6 2/20 0.41
CHRNA9 Q9UGM1 2/20 0.41
SIGMAR1 Q99720 5/20 0.41
GPR84 Q9NQS5 1/20 0.41
NAAA Q02083 1/20 0.40
FFAR1 O14842 1/20 0.40
AKR1B1 P15121 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
MAOA P21397 1/20 0.39
MAPT P10636 1/20 0.39
RXFP1 Q9HBX9 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
SCHEMBL3035756 0.98 AGXT (0.52) AGXTIGF1RALOX15CHRNA7CHRNA10
SCHEMBL5546178 0.92 AGXT (0.53) AGXTIGF1RALOX15GPR84NAAA
SCHEMBL29618101 0.88 SIGMAR1 (0.52) AGXTIGF1RALOX15SIGMAR1MAOA
SCHEMBL5544652 0.84 AGXT (0.57) AGXTGPR84FFAR1AKR1B1FFAR4
SCHEMBL2091393 0.82 AGXT (0.58) AGXTFFAR1
SCHEMBL3019533 0.82 HDAC2 (0.53) SIGMAR1FFAR1MAOAMAPT
SCHEMBL145792 0.82 SIGMAR1 (0.58) SIGMAR1MAOAMAPTRXFP1
SCHEMBL104035 0.82 SIGMAR1 (0.58) SIGMAR1MAOAMAPTRXFP1
SCHEMBL8498459 0.82 SIGMAR1 (0.58) SIGMAR1MAOAMAPTRXFP1
SCHEMBL304117 0.82 SIGMAR1 (0.58) SIGMAR1MAOAMAPTRXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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
US-6492364-B1 Triazolo and derivatives as chemokine inhibitors TORAY INDUSTRIES, INC. (JP) 2002-12-10 US disclosed
CN-1293674-A Triazolo gerivatives and chemokine inhibitors containing the same as the active ingredient TORAY INDUSTRIES (JP) 2001-05-02 CN disclosed
EP-1067130-A1 TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT TORAY INDUSTRIES, INC. (JP) 2001-01-10 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-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 AGXT 2967/4885IGF1R 459/4885ALOX15 2847/4885

“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.