SCHEMBL1509865

SCHEMBL1509865

CC(C)(C)OC(=O)CCCCCCCCC(=O)NCCCOCCCCOCCCNC(=O)CCC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.43
TSHR P16473 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
TLR2 O60603 1/20 0.39
TLR1 Q15399 1/20 0.39
KDM4E B2RXH2 1/20 0.38
RECQL P46063 1/20 0.37
GAA P10253 2/20 0.37
FAAH O00519 3/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
ADRA1A P35348 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL1509891 1.00 EPHX2 (0.43) EPHX2TSHRSMN1; SMN2TLR2TLR1
SCHEMBL1509858 0.97 EPHX2 (0.43) EPHX2TSHRSMN1; SMN2TLR2TLR1
SCHEMBL16538712 0.97 EPHX2 (0.43) EPHX2TSHRSMN1; SMN2TLR2TLR1
SCHEMBL1509898 0.97 EPHX2 (0.43) EPHX2TSHRSMN1; SMN2TLR2TLR1
SCHEMBL29680034 0.93 TSHR (0.46) EPHX2TSHRSMN1; SMN2TLR2TLR1
SCHEMBL1509850 0.91 TLR2 (0.43) EPHX2TSHRTLR2TLR1RECQL
SCHEMBL1509876 0.91 TLR2 (0.43) EPHX2TSHRTLR2TLR1RECQL
SCHEMBL15196457 0.90 EPHX2 (0.43) EPHX2TSHRSMN1; SMN2TLR2TLR1
SCHEMBL20556419 0.89 EPHX2 (0.51) EPHX2KDM4ERECQLGAAADRA1A
SCHEMBL25530748 0.88 GLP1R (0.44) EPHX2TSHRSMN1; SMN2TLR2TLR1

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 15 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
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
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-20100227796-A1 Insulin Derivatives NOVO NORDISK A/S (DK) 2010-09-09 US 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
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
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
EP-1846447-A1 INSULIN DERIVATIVES NOVO NORDISK A/S (DK) 2007-10-24 EP disclosed
WO-2006082205-A1 INSULIN DERIVATIVES NOVO NORDISK A/S (DK) 2006-08-10 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 (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 EPHX2 1255/4885TSHR 1325/4885SMN1; SMN2 4544/4885
US-20120208749-A1 Insulin derivatives IAPP, INSR, GCG EPHX2 1446/4885TSHR 1298/4885SMN1; SMN2 4611/4885
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 EPHX2 2749/4885TSHR 2063/4885SMN1; SMN2 3781/4885

“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.