SCHEMBL5544941

SCHEMBL5544941

Cc1ccc(OC2CCN(C)CC2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.49
HTR2B P41595 2/20 0.49
SCN1A P35498 1/20 0.45
SCN2A Q99250 1/20 0.45
SCN3A Q9NY46 1/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
HRH3 Q9Y5N1 2/20 0.43
SYK P43405 1/20 0.42
HSP90AA1 P07900 1/20 0.42
HSP90AB1 P08238 1/20 0.42
CYP2D6 P10635 1/20 0.41
KDM4E B2RXH2 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
HRH1 P35367 1/20 0.39
CCR3 P51677 1/20 0.39
POLB P06746 1/20 0.39
APOBEC3A P31941 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
SCHEMBL5536788 0.87 HTR2C (0.46) HTR2CHTR2BSCN1ASCN2ASCN3A
SCHEMBL5544938 0.85 SYK (0.41) HTR2CHTR2BSMN1; SMN2HRH3SYK
SCHEMBL19175212 0.84 CYP3A4 (0.47) HTR2CHTR2BSCN1ASCN2ASCN3A
SCHEMBL13419234 0.84 HTR2C (0.47) HTR2CHTR2BSCN1ASCN2ASCN3A
SCHEMBL15219288 0.84 HRH1 (0.50) HTR2CHTR2BSMN1; SMN2HRH3SYK
SCHEMBL8261147 0.84 HTR2C (0.49) HTR2CHTR2BSMN1; SMN2HRH3KDM4E
SCHEMBL10196595 0.84 ACHE (0.52) HTR2CHTR2BSCN1ASCN2ASCN3A
SCHEMBL9921755 0.84 HTR2C (0.53) HTR2CHTR2BSCN1ASCN2ASCN3A
SCHEMBL5504714 0.84 HRH3 (0.44) HTR2CHTR2BSMN1; SMN2HRH3KDM4E
SCHEMBL14578130 0.83 KDM4E (0.40) HTR2CHTR2BSMN1; SMN2HRH3HSP90AA1

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-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-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-7671058-B2 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN, INC. (JP) 2010-03-02 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US disclosed
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2008-09-18 US 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 (2 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 HTR2C 2910/4885HTR2B 3791/4885SCN1A 2660/4885
US-20080227784-A1 N-(3,4-disubstituted phenyl) salicylamide derivatives STAT6, RELA, NFKB2 HTR2C 2964/4885HTR2B 2402/4885SCN1A 1586/4885

“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.