SCHEMBL5536815

SCHEMBL5536815

O=[C]CCOc1ccc(Cl)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH3A1 P30838 1/20 0.47
▸ DRD4 P21917 4/20 0.44
▸ DRD2 P14416 3/20 0.44
▸ DRD3 P35462 3/20 0.44
▸ KCNH2 Q12809 2/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ GPR84 Q9NQS5 1/20 0.44
▸ NPC1 O15118 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ SOD1 P00441 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ MAOB P27338 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ LTA4H P09960 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
SCHEMBL5540013 0.90 ALDH3A1 (0.50) ALDH3A1DRD4DRD2DRD3KCNH2
SCHEMBL5534926 0.88 ALDH3A1 (0.53) ALDH3A1DRD4DRD2DRD3KCNH2
SCHEMBL5539527 0.86 ALDH3A1 (0.51) ALDH3A1DRD4DRD2DRD3KCNH2
SCHEMBL1345118 0.79 MAOB (0.57) ALDH3A1DRD4DRD2DRD3KCNH2
SCHEMBL9415981 0.79 LTA4H (0.50) DRD4DRD2DRD3CYP1A2CYP2C19
SCHEMBL7352169 0.79 NQO1 (0.58) L3MBTL1NPC1SMN1; SMN2MEN1TSHR
SCHEMBL98739 0.79 KDM4E (0.44) DRD4DRD2DRD3L3MBTL1MEN1
SCHEMBL21052116 0.79 L3MBTL1 (0.53) DRD4DRD2DRD3KCNH2L3MBTL1
SCHEMBL8415070 0.79 GAA (0.58) ALDH3A1DRD4DRD2DRD3KCNH2
SCHEMBL7345979 0.79 TDP1 (0.50) L3MBTL1NPC1RAB9ASMN1; SMN2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5221746-A Inhibitors of visna virus; treatment of AIDS and ARC G. D. SEARLE & CO. (US) 1993-06-22 — — US claimed
EP-0494850-A2 Novel antiviral compounds G.D. Searle & Co. (US) 1992-07-15 — — EP claimed
EP-2473493-B1 METHODS OF TREATING POXVIRAL INFECTIONS UNITED THERAPEUTICS CORP (US) 2014-04-30 — — EP disclosed
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
US-6043226-A TREATING BACTERIAL, PARASITIC AND PROTOZOAL INFECTIONS PFIZER INC. (US) 2000-03-28 — — US disclosed
US-5476859-A Inhibiting lentivirus by orally administering derivatives of 1,5-dideoxy-1,5-imino-D-glucitol PARTIS RICHARD A (US) 1995-12-19 — — US disclosed
US-5411970-A Method of inhibiting lentivirus G. D. SEARLE & CO. (US) 1995-05-02 — — US disclosed
US-5310745-A Acylated derivatives of 1,5-dideoxy-1,5-imino-D-glucitol, AIDS G. D. SEARLE & CO. (US) 1994-05-10 — — US disclosed
US-5221746-A Inhibitors of visna virus; treatment of AIDS and ARC G. D. SEARLE & CO. (US) 1993-06-22 — — US disclosed
US-5221746-A Inhibitors of visna virus; treatment of AIDS and ARC G. D. SEARLE & CO. (US) 1993-06-22 — — US disclosed
US-5144037-A Viricides G. D. SEARLE & CO. (US) 1992-09-01 — — US disclosed
US-5144037-A Viricides G. D. SEARLE & CO. (US) 1992-09-01 — — US disclosed
EP-0494850-A2 Novel antiviral compounds G.D. Searle & Co. (US) 1992-07-15 — — EP disclosed
EP-0494850-A2 Novel antiviral compounds G.D. Searle & Co. (US) 1992-07-15 — — EP disclosed
EP-0094348-B1 OXIME ETHERS, PROCESS FOR THEIR PREPARATION, AGENTS CONTAINING THE OXIME ETHERS AND THEIR USE CIBA-GEIGY AG (CH) 1985-07-24 — — 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 ALDH3A1 98/4885DRD4 368/4885DRD2 542/4885

“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.

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