SCHEMBL11952610

SCHEMBL11952610

CC(=O)CCCCOP(=O)(O)OP(C)(=O)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BTN3A1 O00481 2/20 0.43
▸ SAT1 P21673 1/20 0.38
▸ LPAR3 Q9UBY5 3/20 0.36
▸ LPAR1 Q92633 2/20 0.36
▸ LPAR2 Q9HBW0 2/20 0.36
▸ GGPS1 O95749 2/20 0.35
▸ PAOX Q6QHF9 1/20 0.35
▸ MVD P53602 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ P2RY10 O00398 3/20 0.33
▸ GPR34 Q9UPC5 1/20 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
SCHEMBL11952573 0.87 BTN3A1 (0.58) BTN3A1LPAR3LPAR1LPAR2GGPS1
SCHEMBL11952589 0.86 ALDH1A1 (0.50) BTN3A1SAT1MVDALDH1A1
SCHEMBL18258054 0.80 PLA2G2A (0.43) BTN3A1LPAR3LPAR1LPAR2PAOX
SCHEMBL17754043 0.79 LPAR3 (0.57) LPAR3LPAR1LPAR2PAOXALDH1A1
SCHEMBL11952605 0.77 SAT1 (0.42) BTN3A1SAT1LPAR3LPAR1LPAR2
SCHEMBL14099511 0.73 PLA2G4A (0.40) SAT1LPAR3LPAR1LPAR2PAOX
SCHEMBL16792076 0.72 LPAR3 (0.54) BTN3A1LPAR3LPAR1LPAR2PAOX
SCHEMBL11952594 0.71 SAT1 (0.38) BTN3A1SAT1LPAR3LPAR1LPAR2
SCHEMBL91094 0.71 BTN3A1 (0.41) BTN3A1SAT1MVDALDH1A1
SCHEMBL11952592 0.70 MVD (0.54) BTN3A1LPAR3LPAR1LPAR2GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120196835-A1 ENZYME INHIBITING COMPOUNDS AND METHODS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2012-08-02 — — US disclosed

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-20120196835-A1 ENZYME INHIBITING COMPOUNDS AND METHODS COASY, FADS2, FDPS BTN3A1 4124/4885SAT1 2039/4885LPAR3 3076/4885

“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.

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