SCHEMBL8562942

SCHEMBL8562942

COC(=O)C(CC(C)C)CP(=O)(OC)OC

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MME P08473 2/20 0.43
LAP3 P28838 2/20 0.38
ANPEP P15144 1/20 0.38
HSD17B10 Q99714 1/20 0.36
TAS1R3 Q7RTX0 5/20 0.36
TAS1R1 Q7RTX1 5/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
BIRC2 Q13490 1/20 0.35
KISS1R Q969F8 3/20 0.33

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
SCHEMBL8562944 1.00 MME (0.43) MMELAP3ANPEPHSD17B10TAS1R3
SCHEMBL14330752 0.82 FOLH1 (0.36) CA1CA2
SCHEMBL2979680 0.80 MME (0.53) MMETAS1R3TAS1R1CA1CA2
SCHEMBL11449760 0.78 CA1 (0.35) MMEHSD17B10CA1CA2
SCHEMBL8558409 0.76 SMN1; SMN2 (0.37) TAS1R3TAS1R1CA1CA2
SCHEMBL8558408 0.76 SMN1; SMN2 (0.37) TAS1R3TAS1R1CA1CA2
SCHEMBL13885559 0.74 CA1 (0.55) MMETAS1R3TAS1R1CA1CA2
SCHEMBL10196957 0.74 MME (0.57) MMETAS1R3TAS1R1CA1CA2
SCHEMBL15140463 0.74 MME (0.57) MMETAS1R3TAS1R1CA1CA2
SCHEMBL17532256 0.74 CA1 (0.55) MMETAS1R3TAS1R1CA1CA2

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-5739373-A Optically active phosphono analogs of succinates and synthesis thereof MONSANTO COMPANY (US) 1998-04-14 US claimed
US-5739373-A Optically active phosphono analogs of succinates and synthesis thereof MONSANTO COMPANY (US) 1998-04-14 US disclosed