SCHEMBL3822356

SCHEMBL3822356

CC(C)(C)OC(=O)Nc1ccc(NC(=O)OC(C)(C)C)c2c1C(=O)OC2=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
PSMB8 P28062 1/20 0.42
ELANE P08246 1/20 0.41
CTRB1 P17538 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
METAP1 P53582 1/20 0.41
NFKB1 P19838 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
CNR2 P34972 1/20 0.40
BRD9 Q9H8M2 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
MEN1 O00255 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL2880191 0.80 LMNA (0.54) CA12CA1LMNAPOLBRXFP1
SCHEMBL3828974 0.76 MAOA (0.51) LMNAPOLBRXFP1NPC1RAB9A
SCHEMBL2940952 0.74 GAA (0.51) LMNAPOLBRXFP1METAP1BRD9
SCHEMBL1534089 0.74 NPC1 (0.58) LMNAPOLBRXFP1BRD9NPC1
SCHEMBL2880194 0.74 BRD9 (0.52) CA12CA1ELANECTRB1LMNA
SCHEMBL736662 0.74 POLB (0.49) CA12CA1LMNAPOLBRXFP1
SCHEMBL3784448 0.74 GPR35 (0.50) LMNAPOLBRXFP1METAP1BRD9
SCHEMBL1794452 0.74 LMNA (0.49) CA12CA1LMNAPOLBRXFP1
SCHEMBL18623980 0.73 MEN1 (0.61) POLBRXFP1RAB9AMEN1HTT
SCHEMBL9291119 0.72 METAP1 (0.50) CA12CA1CA9PSMB8LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1423115-B9 ANTIANGIOGENIC ACTIVITY OF NITROGEN SUBSTITUTED THALIDOMIDE ANALOGS CHILDRENS MEDICAL CENTER (US) 2009-09-02 EP disclosed
EP-1423115-B1 ANTIANGIOGENIC ACTIVITY OF NITROGEN SUBSTITUTED THALIDOMIDE ANALOGS CHILDRENS MEDICAL CENTER (US) 2009-04-15 EP disclosed
US-20070105903-A1 Synthesis and anti-tumor activity of nitrogen substituted thalidomide analogs CELGENE CORPORATION 2007-05-10 US disclosed
US-7153867-B2 Use of nitrogen substituted thalidomide analogs for the treatment of macular degenerator CELGENE CORPORATION (US) 2006-12-26 US disclosed
EP-1423115-A4 SYNTHESIS AND ANTI-TUMOR ACTIVITY OF NITROGEN SUBSTITUTED THALIDOMIDE ANALOGS CHILDRENS MEDICAL CENTER (US) 2006-08-16 EP disclosed
EP-1423115-A2 SYNTHESIS AND ANTI-TUMOR ACTIVITY OF NITROGEN SUBSTITUTED THALIDOMIDE ANALOGS The Children's Medical Center Corporation (US) 2004-06-02 EP disclosed
US-20030139451-A1 Synthesis and anti-tumor activity of nitrogen substituted thalidomide analogs CHILDREN'S MEDICAL CENTER CORPORATION, THE 2003-07-24 US disclosed
WO-2003014315-A2 SYNTHESIS AND ANTI-TUMOR ACTIVITY OF NITROGEN SUBSTITUTED THALIDOMIDE ANALOGS THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 2003-02-20 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-20030139451-A1 Synthesis and anti-tumor activity of nitrogen substituted thalidomide analogs VEGFA, FLT4, FLT1 CA12 2171/4885CA1 2461/4885CA9 1113/4885
US-20070105903-A1 Synthesis and anti-tumor activity of nitrogen substituted thalidomide analogs VEGFA, FLT4, FLT1 CA12 2171/4885CA1 2461/4885CA9 1113/4885

“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.