SCHEMBL2356987

SCHEMBL2356987

O=Cc1cc2ccccc2c(C(=O)O)c1C=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.59
KDM4E B2RXH2 1/20 0.59
MEN1 O00255 1/20 0.59
ALDH1A1 P00352 1/20 0.59
GLA P06280 1/20 0.59
HPGD P15428 1/20 0.59
CYP2C19 P33261 1/20 0.59
KMT2A Q03164 1/20 0.59
HSD17B10 Q99714 1/20 0.59
ERN1 O75460 5/20 0.45
ME2 P23368 1/20 0.40
ME1 P48163 1/20 0.40
ME3 Q16798 1/20 0.40
METAP2 P50579 1/20 0.40
METAP1 P53582 1/20 0.40
CDC25B P30305 2/20 0.40
CYP3A4 P08684 1/20 0.39
STAT6 P42226 1/20 0.39
HIF1A Q16665 1/20 0.39
MAOB P27338 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
SCHEMBL547540 0.87 KDM4E (0.47) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL9060921 0.86 MEN1 (0.63) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL548198 0.86 KDM4E (0.46) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL547569 0.86 KDM4E (0.46) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL28999818 0.85 CYP1A2 (0.61) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL547787 0.84 ERN1 (0.45) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL3635848 0.83 CYP1A2 (0.59) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL29221780 0.83 MEN1 (0.59) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL547751 0.79 KMT2A (0.41) CYP1A2KDM4EMEN1ALDH1A1GLA
SCHEMBL6545857 0.79 MEN1 (0.58) CYP1A2KDM4EMEN1ALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2350182-B1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HALLSTAR INNOVATIONS CORP (US) 2012-08-15 EP disclosed
EP-2350182-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HallStar Innovations Corp. (US) 2011-08-03 EP disclosed
US-7754191-B2 Method of quenching electronic excitation of chromophore-containing organic molecules photoactive compositions HALLSTAR INNOVATIONS CORP. (US) 2010-07-13 US disclosed
WO-2010051103-A1 METHOD OF QUENCHING ELECTRONIC EXCITATION OF CHROMOPHORE-CONTAINING ORGANIC MOLECULES IN PHOTOACTIVE COMPOSITIONS HALLSTAR INNOVATIONS CORP. (US) 2010-05-06 WO disclosed
US-20090057627-A1 Method of quenching electronic excitation of chromophore-containing organic molecules photoactive compositions HALLSTAR INNOVATIONS CORP. (US) 2009-03-05 US disclosed