SCHEMBL3022984

SCHEMBL3022984

CC(=O)CCCC[N+](=O)[O-]

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
LMNA P02545 2/20 0.46
MEN1 O00255 1/20 0.46
BLM P54132 1/20 0.46
HBB P68871 1/20 0.46
KMT2A Q03164 1/20 0.46
HIF1A Q16665 1/20 0.46
PAOX Q6QHF9 5/20 0.44
TDP1 Q9NUW8 1/20 0.40
ACHE P22303 1/20 0.39
SLC15A2 Q16348 1/20 0.35
CES2 O00748 3/20 0.33
CES1 P23141 3/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL9455702 0.98 ALDH1A1 (0.54) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL6839720 0.98 ALDH1A1 (0.54) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL856486 0.93
SCHEMBL2999774 0.82
SCHEMBL5249440 0.78 LMNA (0.68) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL9680510 0.78 ALDH1A1 (0.52) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL2818271 0.78 KMT2A (0.48) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL4434498 0.77 ALDH1A1 (0.42) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL2371891 0.76 LMNA (0.65) ALDH1A1LMNAMEN1BLMHBB
SCHEMBL2371134 0.76 LMNA (0.65) ALDH1A1LMNAMEN1BLMHBB

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120277420-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-11-01 US disclosed
US-8212055-B2 Refined routes to chlorin building blocks NORTH CAROLINA STATE UNIVERSITY (US) 2012-07-03 US disclosed
US-20100204465-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-08-12 US disclosed
US-7678900-B2 Refined routes to chlorin building blocks NORTH CAROLINA STATE UNIVERSITY (US) 2010-03-16 US disclosed
US-20090069558-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS NORTH CAROLINA STATE UNIVERSITY (US) 2009-03-12 US disclosed
US-7470785-B2 Refined routes to chlorin building blocks NORTH CAROLINA STATE UNIVERSITY (US) 2008-12-30 US disclosed
EP-1848778-A2 DE NOVO SYNTHESIS OF BACTERIOCHLORINS North Carolina State University (US) 2007-10-31 EP disclosed
WO-2006089122-A2 DE NOVO SYNTHESIS OF BACTERIOCHLORINS NORTH CAROLINA STATE UNIVERSITY (US) 2006-08-24 WO disclosed
US-6946552-B2 Refined routes to chlorin building blocks NORTH CAROLINA STATE UNIVERSITY (US) 2005-09-20 US disclosed
US-20050165228-A1 Refined routes to chlorin building blocks NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2005-07-28 US disclosed
US-6559374-B2 Multilayer solar cells NORTH CAROLINA STATE UNIVERSITY 2003-05-06 US disclosed
EP-1303884-A1 SOLAR CELLS INCORPORATING LIGHT HARVESTING ARRAYS NORTH CAROLINA STATE UNIVERSITY (US) 2003-04-23 EP disclosed
US-20020185173-A1 Solar cells incorporating light harvesting arrays NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2002-12-12 US disclosed
WO-2002092601-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS NORTH CAROLINA STATE UNIVERSITY (US) 2002-11-21 WO disclosed
US-6420648-B1 SOLAR CELLS NORTH CAROLINA STATE UNIVERSITY 2002-07-16 US disclosed
US-6407330-B1 A CIRCUIT ELECTRICALLY COUPLED TO SAID SOLAR CELL; LIGHT HARVESTING RODS OF NON-DISCOTIC BACKBONE POLYMER CONTAINING CHROMOPHORE GROUPS NORTH CAROLINA STATE UNIVERSITY 2002-06-18 US disclosed
US-20020033192-A1 Trans beta substituted chlorins and methods of making and using the same NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2002-03-21 US disclosed
WO-2002009196-A1 LIGHT HARVESTING ARRAYS NORTH CAROLINA STATE UNIVERSITY (US) 2002-01-31 WO disclosed
WO-2002008230-A1 TRANS BETA SUBSTITUTED CHLORINS AND METHODS OF MAKING AND USING THE SAME NORTH CAROLINA STATE UNIVERSITY (US) 2002-01-31 WO disclosed
WO-2002009197-A1 SOLAR CELLS INCORPORATING LIGHT HARVESTING ARRAYS NORTH CAROLINA STATE UNIVERSITY (US) 2002-01-31 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-20090069558-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS DHFR, DDT, SHARPIN ALDH1A1 3657/4885LMNA 4378/4885MEN1 394/4885
US-20050165228-A1 Refined routes to chlorin building blocks DHFR, DDT, SHARPIN ALDH1A1 3657/4885LMNA 4378/4885MEN1 394/4885
US-20100204465-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS DHFR, DDT, SHARPIN ALDH1A1 3657/4885LMNA 4378/4885MEN1 394/4885
US-20120277420-A1 REFINED ROUTES TO CHLORIN BUILDING BLOCKS DHFR, DDT, SHARPIN ALDH1A1 3657/4885LMNA 4378/4885MEN1 394/4885

“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.