SCHEMBL5534736

SCHEMBL5534736

Fc1ccc(CN[CH]c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G1B P04054 1/20 0.49
ATG4B Q9Y4P1 1/20 0.49
NFE2L2 Q16236 1/20 0.47
ERAP1 Q9NZ08 1/20 0.47
ALDH1A1 P00352 4/20 0.45
RAB9A P51151 2/20 0.45
ADH1B P00325 1/20 0.44
ADH1C P00326 1/20 0.44
ADH1A P07327 1/20 0.44
ADH7 P40394 1/20 0.44
MAOB P27338 3/20 0.44
NPC1 O15118 1/20 0.44
POLB P06746 1/20 0.44
KDM1A O60341 2/20 0.42
KDM4E B2RXH2 2/20 0.42
KCNH3 Q9ULD8 1/20 0.42
MAOA P21397 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 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
SCHEMBL7385255 0.86 ADH1B (0.58) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL5540801 0.83 CCNE2 (0.38) PLA2G1BATG4BNFE2L2ERAP1ADH1B
SCHEMBL5546127 0.81 ADH1B (0.44) ALDH1A1RAB9AADH1BADH1CADH1A
SCHEMBL5542584 0.81 SMN1; SMN2 (0.49) ALDH1A1RAB9AADH1BADH1CADH1A
SCHEMBL5539505 0.81 LMNA (0.50) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL5544677 0.81 L3MBTL1 (0.45) ALDH1A1ADH1BADH1CADH1AADH7
SCHEMBL5535940 0.80 KDM1A (0.47) NFE2L2ALDH1A1ADH1BADH1CADH1A
SCHEMBL5536817 0.80 NFE2L2 (0.47) NFE2L2RAB9AMAOBPOLBKDM1A
SCHEMBL5534775 0.78 EGFR (0.40) NFE2L2ERAP1ADH1BADH1CADH1A
SCHEMBL5537515 0.77 RAB9A (0.48) ALDH1A1RAB9AADH1BADH1CADH1A

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 7 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
EP-0871619-A1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 1998-10-21 EP disclosed
WO-1997024343-A1 PHENYL THIAZOLE DERIVATIVES WITH ANTI HERPES VIRUS PROPERTIES BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 1997-07-10 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 (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 PLA2G1B 4748/4885ATG4B 4457/4885NFE2L2 846/4885

“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.