SCHEMBL15968278

SCHEMBL15968278

CCCCCCCCCCCCCCCCCC(=O)OCCCOP(=O)([O-])OCC[N+](C)(C)C

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.71
▸ ESR1 P03372 1/20 0.71
▸ ADORA3 P0DMS8 1/20 0.71
▸ CDC25A P30304 1/20 0.71
▸ AGTR1 P30556 1/20 0.71
▸ AKT1 P31749 1/20 0.71
▸ ADRA1A P35348 1/20 0.71
▸ KCNH2 Q12809 1/20 0.71
▸ SMN1; SMN2 Q16637 1/20 0.71
▸ NR5A2 O00482 1/20 0.71
▸ NR5A1 Q13285 1/20 0.71
▸ MAPT P10636 3/20 0.68
▸ RECQL P46063 1/20 0.59
▸ PLA2G1B P04054 1/20 0.58
▸ PLA2G2A P14555 1/20 0.58
▸ FABP3 P05413 1/20 0.56
▸ PLA2G10 O15496 1/20 0.56
▸ MAPK1 P28482 4/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ GMNN O75496 2/20 0.55

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
SCHEMBL4240744 1.00 LMNA (0.71) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL29935531 0.93 SMN1; SMN2 (0.63) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL26018724 0.88 FABP3 (0.70) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL25665820 0.88 FABP3 (0.70) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL14758262 0.88 FABP3 (0.70) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL26061597 0.88 FABP3 (0.70) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL10937572 0.86 SMN1; SMN2 (0.64) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL7720034 0.86 SMN1; SMN2 (0.64) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL1643920 0.86 LMNA (0.66) LMNAESR1ADORA3CDC25AAGTR1
SCHEMBL5475887 0.86 LMNA (0.66) LMNAESR1ADORA3CDC25AAGTR1

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-9943602-B2 Orally bioavailable lipid-based constructs SDG, INC. (US) 2018-04-17 — — US disclosed
US-20140243430-A1 ORALLY BIOAVAILABLE LIPID-BASED CONSTRUCTS SDG, INC. (US) 2014-08-28 — — 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-20140243430-A1 ORALLY BIOAVAILABLE LIPID-BASED CONSTRUCTS FABP2, LIPC, FABP6 LMNA 1669/4885ESR1 2850/4885ADORA3 2835/4885

“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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