SCHEMBL3017008

SCHEMBL3017008

O=P(CO)(CCCO)CCCO

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.33
HPGD P15428 1/20 0.32
CAMK2A Q9UQM7 1/20 0.30

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
SCHEMBL1085822 0.87 TYMS (0.37) TYMSCAMK2A
Water SCHEMBL11146050 0.84 TYMS (0.35) TYMSCAMK2A
SCHEMBL3014053 0.81 PPARD (0.35) TYMSCAMK2A
SCHEMBL3022385 0.81 GPR84 (0.33) TYMSCAMK2A
SCHEMBL823002 0.80 PPARD (0.38) TYMSHPGD
SCHEMBL1085744 0.78 TYMS (0.35) TYMSCAMK2A
SCHEMBL1085805 0.77 ALDH1A1 (0.38) TYMSHPGD
SCHEMBL11777641 0.77 SMN1; SMN2 (0.48) HPGD
SCHEMBL1086382 0.77 ALDH1A1 (0.38) TYMSHPGD
SCHEMBL1085718 0.75 GPR84 (0.39) TYMSCAMK2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8344096-B2 Phosphorus-containing polycarbonate polyol, method for production thereof, and phosphorus-containing polycarbonate polyurethane UBE INDUSTRIES, LTD. (JP) 2013-01-01 US disclosed
US-20100197887-A1 PHOSPHORUS-CONTAINING POLYCARBONATE POLYOL, METHOD FOR PRODUCTION THEREOF, AND PHOSPHORUS-CONTAINING POLYCARBONATE POLYURETHANE UBE INDUSTRIES, LTD. (JP) 2010-08-05 US disclosed