SCHEMBL339734

SCHEMBL339734

CCCCCCCCCCCCCC=C1CCC(OCCOP(=O)(O)OCC[N+]2(CC)CCCCC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 2/20 0.32
P2RY10 O00398 1/20 0.32
LPAR1 Q92633 1/20 0.31
LPAR2 Q9HBW0 1/20 0.31
S1PR1 P21453 2/20 0.31
SGPL1 O95470 2/20 0.31

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
SCHEMBL340043 0.90 CDC25A (0.36) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL338952 0.90 CDC25A (0.36) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL339933 0.90 CDC25A (0.36) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL339733 0.85
SCHEMBL5663655 0.82 LPAR3 (0.36) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL5673069 0.81 FABP3 (0.41) LPAR3S1PR1
SCHEMBL5672161 0.80 LPAR3 (0.34) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL339695 0.79 LPAR3 (0.37) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL339429 0.79 LPAR3 (0.37) LPAR3P2RY10LPAR1LPAR2S1PR1
SCHEMBL339675 0.79 LPAR3 (0.37) LPAR3P2RY10LPAR1LPAR2S1PR1

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-8097752-B2 Antiprotozoal ring-substituted phospholipids MAKSCIENTIFIC, LLC (US) 2012-01-17 US claimed
US-20060105998-A1 Antiprotozoal ring-substiuted phospholipids MAK SCIENTIFIC CORPORATION (US) 2006-05-18 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060105998-A1 Antiprotozoal ring-substiuted phospholipids PHOSPHO1, PLTP, PLA2G2C LPAR3 109/4885P2RY10 712/4885LPAR1 306/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.