SCHEMBL339730

SCHEMBL339730

CN(C)CCCOP(=O)(O)OCCCCCCCCCCCC1CCCCC1

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.59
EPHX1 P07099 1/20 0.40
S1PR4 O95977 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
S1PR5 Q9H228 1/20 0.38
KDM5A P29375 3/20 0.38
PHF8 Q9UPP1 3/20 0.38
KDM2A Q9Y2K7 3/20 0.38
KDM4C Q9H3R0 2/20 0.38
KDM4A O75164 1/20 0.38
NAAA Q02083 4/20 0.37
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM1 P11229 2/20 0.37
CHRM3 P20309 2/20 0.37

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
SCHEMBL17817174 0.84 SIGMAR1 (0.42) SIGMAR1EPHX1S1PR4S1PR1S1PR3
SCHEMBL2696843 0.81 LMNA (0.42) SIGMAR1EPHX1S1PR4S1PR1S1PR3
SCHEMBL2694596 0.81 LMNA (0.42) SIGMAR1EPHX1S1PR4S1PR1S1PR3
SCHEMBL2696736 0.81 LMNA (0.42) SIGMAR1EPHX1S1PR4S1PR1S1PR3
SCHEMBL339731 0.81 LMNA (0.42) SIGMAR1EPHX1S1PR4S1PR1S1PR3
SCHEMBL2694433 0.79 S1PR4 (0.41) EPHX1S1PR4S1PR1S1PR3S1PR5
SCHEMBL339773 0.79 SIGMAR1 (0.38) SIGMAR1S1PR4S1PR1S1PR3S1PR5
SCHEMBL338887 0.79 SIGMAR1 (0.38) SIGMAR1S1PR4S1PR1S1PR3S1PR5
SCHEMBL10781105 0.79 LPAR3 (0.48) SIGMAR1EPHX1S1PR4S1PR1S1PR3
SCHEMBL8657353 0.79 LPAR3 (0.48) SIGMAR1EPHX1S1PR4S1PR1S1PR3

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 4 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
US-8097752-B2 Antiprotozoal ring-substituted phospholipids MAKSCIENTIFIC, LLC (US) 2012-01-17 US disclosed
US-20060105998-A1 Antiprotozoal ring-substiuted phospholipids MAK SCIENTIFIC CORPORATION (US) 2006-05-18 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-20060105998-A1 Antiprotozoal ring-substiuted phospholipids PHOSPHO1, PLTP, PLA2G2C SIGMAR1 1462/4885EPHX1 184/4885S1PR4 286/4885

“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.