SCHEMBL3488909

SCHEMBL3488909

CCCCCCCCCC(CCCCCC)OS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
SMPD1 P17405 3/20 0.38
CA1 P00915 6/20 0.38
CA2 P00918 6/20 0.38
CA9 Q16790 6/20 0.38
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
CA12 O43570 2/20 0.38
CA3 P07451 2/20 0.38
CA4 P22748 2/20 0.38
CA6 P23280 2/20 0.38
CA5A P35218 2/20 0.38
CA7 P43166 2/20 0.38
CA14 Q9ULX7 2/20 0.38
CA5B Q9Y2D0 2/20 0.38
FFAR1 O14842 1/20 0.38

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
SCHEMBL15211949 1.00 TP53 (0.41) TP53SMPD1CA1CA2CA9
SCHEMBL13499764 1.00 TP53 (0.41) TP53SMPD1CA1CA2CA9
SCHEMBL3080295 1.00 TP53 (0.41) TP53SMPD1CA1CA2CA9
SCHEMBL6307966 0.98 TP53 (0.42) TP53SMPD1CA1CA2CA9
SCHEMBL12537420 0.96 TP53 (0.38) TP53SMPD1CA1CA2CA9
SCHEMBL3858246 0.96 TP53 (0.38) TP53SMPD1CA1CA2CA9
SCHEMBL3858248 0.96 TP53 (0.38) TP53SMPD1CA1CA2CA9
SCHEMBL13258344 0.94 TP53 (0.39) TP53SMPD1CA1CA2CA9
SCHEMBL1036357 0.92 LMNA (0.41) TP53SMPD1CA1CA2CA9
SCHEMBL7919742 0.92 ZDHHC7 (0.37) TP53SMPD1CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100076055-A1 Cationic Lipids and Uses Thereof ABBOTT LABORATORIES (US) 2010-03-25 US disclosed
US-20100055169-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-04 US disclosed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO 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 (2 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-20100076055-A1 Cationic Lipids and Uses Thereof LIPA, SGMS2, SGMS1 TP53 3181/4885SMPD1 58/4885CA1 3608/4885
US-20100055169-A1 CATIONIC LIPIDS AND USES THEREOF LIPA, SGMS2, SGMS1 TP53 3181/4885SMPD1 58/4885CA1 3608/4885

“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.