SCHEMBL4447635

SCHEMBL4447635

CCCC[P+](CCCC)(CCCC)CCCC.O=P(=O)[O-]

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.60
CA2 P00918 6/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
FDPS P14324 1/20 0.39
MAPK1 P28482 1/20 0.37
BDKRB2 P30411 1/20 0.37
CA1 P00915 3/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 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
SCHEMBL3840485 0.88 DNM1 (0.67) DNM1CA2TSHRSMN1; SMN2FDPS
SCHEMBL7180455 0.85 DNM1 (0.63) DNM1CA2TSHRSMN1; SMN2FDPS
SCHEMBL7183380 0.85 DNM1 (0.63) DNM1CA2TSHRSMN1; SMN2FDPS
SCHEMBL7172940 0.85 DNM1 (0.63) DNM1CA2TSHRSMN1; SMN2FDPS
SCHEMBL2864120 0.84 DNM1 (0.71) DNM1CA2TSHRSMN1; SMN2FDPS
SCHEMBL29496398 0.84 DNM1 (0.80) DNM1CA2TSHRSMN1; SMN2FDPS
Phosphoric Acid SCHEMBL266936 0.82 DNM1 (0.60) DNM1CA2TSHRSMN1; SMN2FDPS
Phosphoric Acid SCHEMBL9063702 0.82 DNM1 (0.60) DNM1CA2TSHRSMN1; SMN2FDPS
SCHEMBL6909589 0.82 DNM1 (0.60) DNM1CA2FDPSMAPK1BDKRB2
SCHEMBL6907122 0.82 DNM1 (0.60) DNM1CA2FDPSMAPK1BDKRB2

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
US-8575302-B2 Polylactide composition TEIJIN LIMITED (JP) 2013-11-05 US claimed
EP-1956045-B1 POLYLACTIC ACID COMPOSITION TEIJIN LTD (JP) 2013-11-20 EP disclosed
US-8575302-B2 Polylactide composition TEIJIN LIMITED (JP) 2013-11-05 US disclosed
US-20090234094-A1 POLYLACTIDE COMPOSITION TEIJIN LIMITED (JP) 2009-09-17 US disclosed
EP-1956045-A1 POLYLACTIC ACID COMPOSITION TEIJIN LIMITED (JP) 2008-08-13 EP disclosed