SCHEMBL5544172

SCHEMBL5544172

CCCCOc1ccc(-c2nc3c[c]ccc3s2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATP4A P20648 11/20 0.60
ATP4B P51164 11/20 0.60
HTT P42858 1/20 0.48
RAB9A P51151 4/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 1/20 0.48
RXFP1 Q9HBX9 1/20 0.45
KDM4E B2RXH2 3/20 0.44
NPC1 O15118 3/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
PKM P14618 1/20 0.44
CYP2D6 P10635 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP19A1 P11511 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 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
SCHEMBL5537661 0.86 ATP4A (0.56) ATP4AATP4BHTTRAB9AMAPT
SCHEMBL15462904 0.81 ATP4A (0.83) ATP4AATP4BRAB9AMAPTLMNA
SCHEMBL5831358 0.78 ATP4A (0.78) ATP4AATP4BRAB9AMAPTLMNA
SCHEMBL19229535 0.78 ATP4A (0.78) ATP4AATP4BRAB9AMAPTLMNA
SCHEMBL5946741 0.78 ATP4A (0.78) ATP4AATP4BRAB9AMAPTLMNA
SCHEMBL15462905 0.77 HTT (0.77) ATP4AATP4BHTTRAB9AMAPT
SCHEMBL3724320 0.75 ATP4A (0.60) ATP4AATP4BHTTRAB9AMAPT
SCHEMBL5053235 0.75 ATP4A (0.60) ATP4AATP4BHTTRAB9AMAPT
SCHEMBL3964625 0.74 KDM4E (0.49) RAB9AMAPTLMNAKDM4ENPC1
SCHEMBL10000258 0.74 ATP4A (0.56) ATP4AATP4BHTTRAB9AMAPT

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 5 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

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 ATP4A 1651/4885ATP4B 1552/4885HTT 4644/4885

“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.