SCHEMBL3323738

SCHEMBL3323738

CCCCCCCCCC[C@H]1CCCC(=O)C1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.53
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
PPARG P37231 1/20 0.37
NOS1 P29475 3/20 0.37
NOS2 P35228 3/20 0.37
EPHX1 P07099 1/20 0.36
NOS3 P29474 1/20 0.36
NAAA Q02083 1/20 0.35
LSS P48449 2/20 0.35
CCR2 P41597 1/20 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
SCHEMBL11009926 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL9147219 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL14862830 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL10719856 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL5228161 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL18800105 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL16160401 0.98 CYP1A2 (0.54) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL5878611 0.98 CYP1A2 (0.54) CYP1A2ALDH1A1L3MBTL1PPARGNOS1
SCHEMBL7804803 0.93 CYP1A2 (0.50) CYP1A2ALDH1A1L3MBTL1NOS1NOS2
SCHEMBL7741474 0.93 CYP1A2 (0.53) CYP1A2ALDH1A1L3MBTL1NOS1NOS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8492574-B2 Methods for preparing dioranozinc compounds CHARETTE ANDRE (CA) 2013-07-23 US disclosed
US-8492574-B2 Methods for preparing dioranozinc compounds CHARETTE ANDRE (CA) 2013-07-23 US disclosed
US-8492574-B2 Methods for preparing dioranozinc compounds CHARETTE ANDRE (CA) 2013-07-23 US disclosed
US-20100121089-A1 Methods for preparing dioranozinc compounds CHARETTE ANDRE 2010-05-13 US disclosed
US-20100121089-A1 Methods for preparing dioranozinc compounds CHARETTE ANDRE 2010-05-13 US disclosed
US-20100121089-A1 Methods for preparing dioranozinc compounds CHARETTE ANDRE 2010-05-13 US disclosed
WO-2008134890-A1 METHODS FOR PREPARING DIORGANOZINC COMPOUNDS VALORISATION-RECHERCHE, SOCIETE EN COMMANDITE (CA) 2008-11-13 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 (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-20100121089-A1 Methods for preparing dioranozinc compounds ZRANB2, PRMT1, RDX CYP1A2 26/4885ALDH1A1 2252/4885L3MBTL1 1670/4885

“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.