SCHEMBL3953288

SCHEMBL3953288

CCCCC(N)(N)Oc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 2/20 0.44
MLNR O43193 1/20 0.37
NR1I2 O75469 1/20 0.37
ESR1 P03372 1/20 0.37
NR3C1 P04150 1/20 0.37
PGR P06401 1/20 0.37
ADRB2 P07550 1/20 0.37
CHRM2 P08172 1/20 0.37
ADRB1 P08588 1/20 0.37
HTR1A P08908 1/20 0.37
ADRA2A P08913 1/20 0.37
ADORA3 P0DMS8 1/20 0.37
CHRM1 P11229 1/20 0.37
DRD2 P14416 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
CHRM3 P20309 1/20 0.37
MAOA P21397 1/20 0.37
CNR1 P21554 1/20 0.37
SLC6A2 P23975 1/20 0.37

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
SCHEMBL6245906 0.93 LTA4H (0.43) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL23151884 0.93 LTA4H (0.43) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL1454708 0.82 LTA4H (0.46) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL292317 0.77 LTA4H (0.44) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL515722 0.77 LTA4H (0.44) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL25265811 0.77 LTA4H (0.44) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL1454452 0.77 LTA4H (0.46) LTA4HMLNRNR1I2ESR1NR3C1
SCHEMBL5514895 0.77 PPARG (0.43) LTA4HALDH1A1
SCHEMBL28525750 0.77 LTA4H (0.42) LTA4HMLNRNR1I2ESR1NR3C1
Bromide SCHEMBL25222066 0.76 LTA4H (0.43) LTA4HMLNRNR1I2ESR1NR3C1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090227649-A1 Management of Ophthalmologic Disorders, Including Macular Degeneration PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-09-10 US disclosed
US-7566808-B2 Management of ophthalmologic disorders, including macular degeneration PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2009-07-28 US disclosed
US-20080269324-A1 Management of Ophthalmologic Disorders, Including Macular Degeneration NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-10-30 US disclosed
CN-101282925-A Management of ophthalmologic disorders, including macular degeneration HARVARD COLLEGE (US) 2008-10-08 CN disclosed
US-20080176952-A1 Management of Ophthalmologic Disorders, Including Macular Degeneration NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-07-24 US disclosed
EP-1919858-A2 MANAGEMENT OF OPHTHALMOLOGIC DISORDERS, INCLUDING MACULAR DEGENERATION The President and Fellows of Harvard College (US) 2008-05-14 EP disclosed
CN-1997359-A Treatment of ophthalmic diseases including macular degeneration HARVARD COLLEGE (US) 2007-07-11 CN disclosed
WO-2007019503-A2 MANAGEMENT OF OPHTHALMOLOGIC DISORDERS, INCLUDING MACULAR DEGENERATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-02-15 WO disclosed
EP-1722766-A2 MANAGEMENT OF OPHTHALMOLOGIC DISORDERS, INCLUDING MACULAR DEGENERATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2006-11-22 EP disclosed
US-20060069078-A1 Management of ophthalmologic disorders, including macular degeneration NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2006-03-30 US disclosed
WO-2005079774-A2 MANAGEMENT OF OPHTHALMOLOGIC DISORDERS, INCLUDING MACULAR DEGENERATION PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2005-09-01 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 (4 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-20090227649-A1 Management of Ophthalmologic Disorders, Including Macular Degeneration ALDH1A2, PDE6C, PDE6A LTA4H 1172/4885MLNR 1567/4885NR1I2 1909/4885
US-20080176952-A1 Management of Ophthalmologic Disorders, Including Macular Degeneration ALDH1A2, PDE6C, PDE6A LTA4H 1257/4885MLNR 1638/4885NR1I2 1924/4885
US-20060069078-A1 Management of ophthalmologic disorders, including macular degeneration ALDH1A2, PDE6C, PDE6B LTA4H 1396/4885MLNR 1846/4885NR1I2 1159/4885
US-20080269324-A1 Management of Ophthalmologic Disorders, Including Macular Degeneration PDE6C, PDE6A, ALDH1A2 LTA4H 1858/4885MLNR 1804/4885NR1I2 2880/4885

“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.