SCHEMBL2097149

SCHEMBL2097149

Cc1cc(C)c(CN2CC[N]CC2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 3/20 0.46
EPHX2 P34913 1/20 0.43
CYP11B1 P15538 1/20 0.43
CYP11B2 P19099 1/20 0.43
HTR1D P28221 1/20 0.39
HTR1B P28222 1/20 0.39
MEN1 O00255 1/20 0.38
MAPK1 P28482 1/20 0.38
KMT2A Q03164 1/20 0.38
CFB P00751 1/20 0.36
GALR3 O60755 2/20 0.35
NR2F2 P24468 2/20 0.35

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
SCHEMBL2090689 0.93 HRH3 (0.49) HRH3EPHX2CYP11B1CYP11B2HTR1D
SCHEMBL10705219 0.84 HTR1D (0.49) HRH3EPHX2HTR1DHTR1BMAPK1
SCHEMBL918507 0.81 KMT2A (0.41) HTR1DMEN1KMT2ACFB
SCHEMBL3971875 0.78 CYP11B1 (0.42) CYP11B1CYP11B2MEN1KMT2A
SCHEMBL11891933 0.78 HRH3 (0.52) HRH3EPHX2
SCHEMBL26121408 0.78 HRH3 (0.47) HRH3EPHX2CYP11B1CYP11B2MEN1
SCHEMBL10701848 0.77 HRH3 (0.46) HRH3EPHX2CYP11B1CYP11B2MEN1
SCHEMBL593755 0.77 LMNA (0.50) HRH3EPHX2CYP11B1CYP11B2MEN1
SCHEMBL5540745 0.77 GRIN2B (0.50) MAPK1
SCHEMBL27978872 0.74 EPHX2 (0.51) HRH3EPHX2CYP11B1CYP11B2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0284552-A1 4-Benzyl-piperazinyl-hydrazones CIBA-GEIGY AG (CH) 1988-09-28 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-8163753-B2 2-(4-(4-(4-chlorophenyl)oxazol-2-yl)phenoxymethyl)-2-methyl-6-nitro-2,3-dihydroimidazo[2,1-b]oxazole; bactericide; excellent bactericidal action against Mycobacterium tuberculosis, multi-drug-resistant Mycobacterium tuberculosis, and atypical acid-fast bacteria OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-04-24 US disclosed
EP-1678185-B1 2,3-DIHYDRO-6-NITROIMIDAZO [2,1-B] OXAZOLE COMPOUNDS FOR THE TREATMENT OF TUBERCULOSIS OTSUKA PHARMA CO LTD (JP) 2008-10-08 EP disclosed
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis OTSUKA PHAMACEUTICAL CO., LTD. (JP) 2008-05-22 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
EP-0293054-A2 Novel diglycidyl ethers of diphenolic alkanes and their use in curable compositions SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1988-11-30 EP disclosed
EP-0284552-A1 4-Benzyl-piperazinyl-hydrazones CIBA-GEIGY AG (CH) 1988-09-28 EP disclosed
US-4391642-A SACCHARIDE, PHENOL FOSECO INTERNATIONAL LIMITED (GB) 1983-07-05 US disclosed
EP-0024392-B1 ALKALI METAL SILICATE BINDER COMPOSITIONS FOSECO INTERNATIONAL LIMITED (GB) 1982-08-04 EP disclosed
EP-0024392-A1 ALKALI METAL SILICATE BINDER COMPOSITIONS. FOSECO INT (GB) 1981-03-11 EP disclosed
WO-1980001768-A1 ALKALI METAL SILICATE BINDER COMPOSITIONS FOSECO INT (GB) 1980-09-04 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 (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 HRH3 420/4885EPHX2 3662/4885CYP11B1 514/4885
US-20080119478-A1 2,3-Dihydro-6-Nitroimidazo (2,1-b) Oxazole Compounds for the Treatment of Tuberculosis NR2C2, NR0B2, NR4A2 HRH3 538/4885EPHX2 3472/4885CYP11B1 1131/4885

“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.