SCHEMBL13159369

SCHEMBL13159369

NCCOCCOCCN1C(=O)c2ccc(C(=O)c3ccc4c(c3)C(=O)N(CCOCCOCCN)C4=O)cc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 6/20 0.58
▸ TSHR P16473 1/20 0.58
▸ ENPP2 Q13822 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ POLB P06746 1/20 0.43
▸ CA1 P00915 2/20 0.42
▸ CA2 P00918 2/20 0.42
▸ CA4 P22748 2/20 0.42
▸ CA9 Q16790 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ ACHE P22303 1/20 0.42
▸ LMNA P02545 1/20 0.41

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
SCHEMBL26349218 0.81 ALDH1A1 (0.52) ALDH1A1TSHRENPP2SMN1; SMN2POLB
SCHEMBL13952879 0.81 ALDH1A1 (0.42) ALDH1A1TSHRENPP2SMN1; SMN2POLB
SCHEMBL12317642 0.79 GAA (0.51) ALDH1A1TSHRSMN1; SMN2HPGDTDP1
SCHEMBL10126593 0.79 GAA (0.51) ALDH1A1TSHRSMN1; SMN2HPGDTDP1
SCHEMBL13159360 0.79 ALDH1A1 (0.71) ALDH1A1TSHRENPP2SMN1; SMN2POLB
SCHEMBL11957411 0.78 HPGD (0.53) ALDH1A1TSHRSMN1; SMN2HPGDTDP1
SCHEMBL10491216 0.76 ALDH1A1 (0.82) ALDH1A1TSHRENPP2SMN1; SMN2POLB
SCHEMBL14262509 0.74 ALDH1A1 (0.56) ALDH1A1TSHRENPP2SMN1; SMN2POLB
SCHEMBL13159438 0.74 ALDH1A1 (0.63) ALDH1A1TSHRENPP2SMN1; SMN2POLB
SCHEMBL17946077 0.73 ALDH1A1 (0.75) ALDH1A1TSHRENPP2SMN1; SMN2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160325267-A1 USE OF PHOTOSENSITIVE MOLECULES AND METAL COMPLEXES AS OXYGEN SCAVENGER ELEMENTS BASF SE (DE) 2016-11-10 — — US disclosed
US-9441066-B2 Use of photosensitive molecules and metal complexes as oxygen scavenger elements BASF SE (DE) 2016-09-13 — — US disclosed
US-20120305850-A1 USE OF PHOTOSENSITIVE MOLECULES AND METAL COMPLEXES AS OXYGEN SCAVENGER ELEMENTS BASF SE (DE) 2012-12-06 — — US disclosed
US-20100222454-A1 DEGRADATION ACCELERATOR FOR POLYMERS AND POLYMER ARTICLE COMPRISING IT CIBA CORPORATION (US) 2010-09-02 — — US disclosed
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