SCHEMBL5537149

SCHEMBL5537149

[CH2]CCc1cccc2ncccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.54
TBXAS1 P24557 1/20 0.54
MAPT P10636 2/20 0.50
KDM4E B2RXH2 1/20 0.50
LOXL2 Q9Y4K0 1/20 0.44
POLB P06746 1/20 0.43
CHRM1 P11229 2/20 0.41
CYP3A4 P08684 1/20 0.41
LMNA P02545 3/20 0.41
HTT P42858 2/20 0.41
ALDH1A1 P00352 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
GLS O94925 1/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90AB1 P08238 1/20 0.40
BLM P54132 1/20 0.40
HIF1A Q16665 1/20 0.40
CYP1A2 P05177 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
SCHEMBL5542601 0.89 CYP19A1 (0.51) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL5543653 0.87 CYP19A1 (0.50) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL4818347 0.86 LOXL2 (0.60) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL5544068 0.86 CYP19A1 (0.49) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL3817705 0.84 MAPT (0.54) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL28131327 0.82 MAPT (0.52) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL6114797 0.81 CYP19A1 (0.54) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL22497966 0.81 CYP19A1 (0.54) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL6970292 0.81 CYP19A1 (0.54) CYP19A1TBXAS1MAPTKDM4ELOXL2
SCHEMBL5500729 0.81 CYP19A1 (0.54) CYP19A1TBXAS1MAPTKDM4ELOXL2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020077302-A1 Tricyclic erythromycin derivatives PFIZER PRODUCTS INC. 2002-06-20 US claimed
US-20020061856-A1 Novel tricyclic erythromycin derivatives PFIZER INC. 2002-05-23 US claimed
CN-114539129-A Allylamine bifunctional compound and application thereof 上海中医药大学附属龙华医院 2022-05-27 CN disclosed
CN-102532162-B 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2015-05-27 CN 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
CN-102532162-A 2,3-dihydro-6-nitroimidazo[2,1-b]oxazoles OTSUKA PHARMA CO LTD 2012-07-04 CN disclosed
CN-101255170-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-09-03 CN disclosed
CN-101172981-A 2,3-dihydroimidazo[2,1-b]oxazole compound OTSUKA PHARMA CO LTD (JP) 2008-05-07 CN disclosed
CN-100366624-C 2, 3-dihydro-6-nitroimidazo [2,1-b ] * azole compounds OTSUKA PHARMA CO LTD (JP) 2008-02-06 CN 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-1585775-A 6-O-acyl ketolide derivatives of erythromycine useful as antibacterials ORTHO MCNEIL PHARM INC (US) 2005-02-23 CN disclosed
US-6825170-B2 ERYTHROMYCIN TYPE MACROLIDE WITH A FUSED OXAZOLONE RING ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-11-30 US disclosed
EP-1453847-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS Ortho-Mcneil Pharmaceutical, Inc. (US) 2004-09-08 EP disclosed
WO-2003050132-A1 6-O-ACYL KETOLIDE DERIVATIVES OF ERYTHROMYCINE USEFUL AS ANTIBACTERIALS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2003-06-19 WO disclosed
US-20020077302-A1 Tricyclic erythromycin derivatives PFIZER PRODUCTS INC. 2002-06-20 US disclosed
US-20020061856-A1 Novel tricyclic erythromycin derivatives PFIZER INC. 2002-05-23 US 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 (3 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-20020077302-A1 Tricyclic erythromycin derivatives MRPL21, CYP7A1, CYP3A7 CYP19A1 241/4885TBXAS1 2012/4885MAPT 4043/4885
US-20060094767-A1 2,3-Dihydro-6-nitroimidazo[2,1-b]oxazoles NR2C2, NR4A3, NR4A2 CYP19A1 3120/4885TBXAS1 2580/4885MAPT 4117/4885
US-20020061856-A1 Novel tricyclic erythromycin derivatives MRPL21, CYP7A1, CYP3A7 CYP19A1 279/4885TBXAS1 1144/4885MAPT 4056/4885

“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.