SCHEMBL1509860

SCHEMBL1509860

CC(C)(C)OC(=O)CCCCCCCCCCCCCCCCC(=O)NCCOCCOCCOCCOCCC(=O)NC(CCC(=O)OC(C)(C)C)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR2 O60603 1/20 0.40
TLR1 Q15399 1/20 0.40
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GLP1R P43220 8/20 0.38
KMT2A Q03164 2/20 0.38
PLK1 P53350 1/20 0.37
FOLH1 Q04609 2/20 0.34
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
POLB P06746 1/20 0.34
GLO1 Q04760 1/20 0.33
P2RY12 Q9H244 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
SCHEMBL1510027 1.00 TLR2 (0.40) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL1509848 0.97 HPGD (0.39) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL11922646 0.92 HPGD (0.38) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL1676784 0.91 TLR2 (0.40) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL12806518 0.91 TLR2 (0.40) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL20467703 0.91 TLR2 (0.40) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL1509877 0.91 KMT2A (0.38) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL1509890 0.91 KMT2A (0.38) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL15579833 0.91 TLR2 (0.40) TLR2TLR1HPGDHTTSMN1; SMN2
SCHEMBL20450588 0.88 GLP1R (0.40) TLR2TLR1HPGDHTTSMN1; SMN2

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-8859493-B2 Insulin derivatives NOVO NORDISK A/S (DK) 2014-10-14 US disclosed
EP-2292653-B1 Novel insulin derivatives NOVO NORDISK AS (DK) 2014-05-21 EP disclosed
EP-1846447-B1 INSULIN DERIVATIVES NOVO NORDISK AS (DK) 2013-08-21 EP disclosed
US-20120208749-A1 Insulin derivatives NOVO NORDISK A/S (DK) 2012-08-16 US disclosed
EP-2292653-A1 Novel insulin derivatives Novo Nordisk A/S (DK) 2011-03-09 EP disclosed
US-20100227796-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2010-09-09 US disclosed
US-20080171695-A1 Acylated with polyethylene glycol, polypropylene glycol or polybutylene glycol in combination with a fatty diacid; improved bioavailability, first pass effect, solubility at physiological pH values and prolonged pharmacokinetics NOVO NORDISK A/S (DK) 2008-07-17 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 (3 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-20100227796-A1 Insulin Derivatives IAPP, INSR, GCG TLR2 2281/4885TLR1 2565/4885HPGD 1717/4885
US-20120208749-A1 Insulin derivatives IAPP, INSR, GCG TLR2 2632/4885TLR1 2668/4885HPGD 2207/4885
US-20080171695-A1 Acylated with polyethylene glycol, polypropylene glycol or polybutylene glycol in combination with a fatty diacid; improved bioavailability, first pass effect, solubility at physiological pH values and prolonged pharmacokinetics IAPP, FABP4, INSR TLR2 1097/4885TLR1 528/4885HPGD 768/4885

“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.