SCHEMBL5542969

SCHEMBL5542969

CNCCOc1[c]cccc1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR1B P28222 4/20 0.53
HTR1D P28221 2/20 0.53
KDM4E B2RXH2 6/20 0.43
ALDH1A1 P00352 3/20 0.42
LMNA P02545 2/20 0.42
GAA P10253 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
CHRNB2 P17787 1/20 0.41
CHRNA4 P43681 1/20 0.41
HRH1 P35367 2/20 0.40
SLC6A4 P31645 1/20 0.40
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL6238419 0.82 JAK2 (0.33) KDM4EALDH1A1LMNAGAATDP1
SCHEMBL5250178 0.81 HTR1B (0.34) HTR1BHTR1DKDM4E
SCHEMBL7329089 0.81 GAA (0.48) HTR1BHTR1DKDM4EALDH1A1LMNA
SCHEMBL27539916 0.80 HTR1B (0.44) HTR1BKDM4EMEN1KMT2A
SCHEMBL7023418 0.80 HTR1B (0.50) HTR1BKDM4EALDH1A1LMNATDP1
SCHEMBL126227 0.79 ALDH1A1 (0.34) KDM4EALDH1A1LMNAGAAMEN1
SCHEMBL7329092 0.78 ALDH1A1 (0.42) KDM4EALDH1A1LMNATDP1MEN1
SCHEMBL314763 0.77 TSHR (0.40)
SCHEMBL49991 0.77 LTA4H (0.46) KDM4EALDH1A1GAATDP1L3MBTL1
SCHEMBL8217123 0.77 KMT2A (0.33) KDM4EMEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0290012-A1 TGF-B2 and novel compositions having anti-neoplastic activity ONCOGEN (US) 1988-11-09 EP claimed
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
CN-1705670-A 2, 3-dihydro-6-nitroimidazo [2, 1-b ] oxazole compounds OTSUKA PHARMA CO LTD (JP) 2005-12-07 CN disclosed
EP-1555267-A1 2,3-DIHYDRO-6-NITROIMIDAZO 2,1-b OXAZOLES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2005-07-20 EP disclosed
CN-1067071-C Carboline derivatives ICOS CORP (US) 2001-06-13 CN disclosed
CN-1218471-A Carboline derivatives ICOS CORP (US) 1999-06-02 CN 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 HTR1B 3275/4885HTR1D 3378/4885KDM4E 4854/4885

“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.