SCHEMBL12977313

SCHEMBL12977313

CCCCCCCCCCC(C)C(O)CN(C)CCCNCC(O)CC

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GGPS1 O95749 3/20 0.35
SPHK1 Q9NYA1 1/20 0.34
ANPEP P15144 1/20 0.32
ERAP2 Q6P179 1/20 0.32
LMNA P02545 1/20 0.30

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
SCHEMBL12977302 1.00 GGPS1 (0.35) GGPS1SPHK1ANPEPERAP2LMNA
SCHEMBL13354518 0.91 GGPS1 (0.38) GGPS1SPHK1ANPEPERAP2LMNA
SCHEMBL13354589 0.90 GGPS1 (0.35) GGPS1SPHK1ANPEPERAP2LMNA
SCHEMBL12976837 0.85 SPHK1 (0.35) GGPS1SPHK1ANPEPERAP2LMNA
SCHEMBL16500368 0.85 GGPS1 (0.32) GGPS1
SCHEMBL16919598 0.85 SPHK1 (0.31) GGPS1SPHK1
SCHEMBL19130689 0.84 GGPS1 (0.30) GGPS1
SCHEMBL12977029 0.82 L3MBTL1 (0.30)
SCHEMBL12977305 0.82 EPHX1 (0.41) GGPS1SPHK1LMNA
SCHEMBL12977314 0.82 EPHX1 (0.41) GGPS1SPHK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170204075-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-07-20 US disclosed
US-9556110-B2 Aminoalcohol lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2017-01-31 US disclosed
US-20150203439-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY 2015-07-23 US disclosed
US-8969353-B2 Aminoalcohol lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2015-03-03 US disclosed
US-8450298-B2 Aminoalcohol lipidoids and uses thereof MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2013-05-28 US disclosed
US-20110293703-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2011-12-01 US disclosed
US-20100331234-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2010-12-30 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 (4 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-20150203439-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF PHOSPHO1, PNMT, AASDHPPT GGPS1 91/4885SPHK1 913/4885ANPEP 176/4885
US-20110293703-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF PHOSPHO1, PNMT, AASDHPPT GGPS1 91/4885SPHK1 913/4885ANPEP 176/4885
US-20170204075-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF PHOSPHO1, PNMT, AASDHPPT GGPS1 91/4885SPHK1 913/4885ANPEP 176/4885
US-20100331234-A1 AMINOALCOHOL LIPIDOIDS AND USES THEREOF PHOSPHO1, PNMT, AASDHPPT GGPS1 91/4885SPHK1 913/4885ANPEP 176/4885

“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.