SCHEMBL3869947

SCHEMBL3869947

CC(=O)c1ccc(C(=O)NCCCCC(N)C(N)=O)cc1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
MAPK1 P28482 1/20 0.45
ITGB3 P05106 2/20 0.45
ITGA2B P08514 2/20 0.45
POLB P06746 1/20 0.44
CA2 P00918 1/20 0.44
FOLH1 Q04609 5/20 0.44
TERT O14746 2/20 0.43
NAAA Q02083 1/20 0.43
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL3862959 1.00 NPC1 (0.47) NPC1RAB9AALDH1A1L3MBTL1MAPK1
SCHEMBL12238275 0.89 GRM8 (0.50) NPC1RAB9AALDH1A1L3MBTL1MAPK1
SCHEMBL12267029 0.89 GRM8 (0.50) NPC1RAB9AALDH1A1L3MBTL1MAPK1
SCHEMBL8199417 0.89 GRM8 (0.50) NPC1RAB9AALDH1A1L3MBTL1MAPK1
Hydrochloric Acid SCHEMBL2327708 0.87 GRM8 (0.49) NPC1RAB9AALDH1A1MAPK1FOLH1
SCHEMBL17690014 0.87 HDAC3 (0.49) NPC1RAB9AALDH1A1L3MBTL1MAPK1
SCHEMBL3862343 0.87 SMN1; SMN2 (0.54) L3MBTL1TERTNAAASMN1; SMN2
SCHEMBL13884683 0.86 ITGB3 (0.47) NPC1RAB9AALDH1A1L3MBTL1MAPK1
SCHEMBL4889040 0.85 HDAC1 (0.56) NPC1RAB9AALDH1A1MAPK1POLB
SCHEMBL13884634 0.83 FOLH1 (0.47) NPC1RAB9AALDH1A1L3MBTL1FOLH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100580087-C Conjugation of peptides NOVO NORDISK HEALTHCARE AG 2010-01-13 CN claimed
US-20090253166-A1 Conjugation of Peptides NOVO NORDISK A/S (DK) 2009-10-08 US claimed
US-20090105134-A1 C-Terminally Pegylated Growth Hormones NOVO NORDISK A/S (DK) 2009-04-23 US claimed
JP-2008531482-A 2008-08-14 JP claimed
EP-1850878-A2 C-TERMINALLY PEGYLATED GROWTH HORMONES NOVO NORDISK A/S (DK) 2007-11-07 EP claimed
US-20070111926-A1 Conjugation of peptides NOVO NORDISK A/S (DK) 2007-05-17 US claimed
CN-1863920-A Conjugation of peptides NOVO NORDISK AS (DK) 2006-11-15 CN claimed
WO-2006084888-A2 C-TERMINALLY PEGYLATED GROWTH HORMONES NOVO NORDISK A/S (DK) 2006-08-17 WO claimed
EP-1673464-A2 CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2006-06-28 EP claimed
WO-2005035553-A2 CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2005-04-21 WO claimed
CN-100580087-C Conjugation of peptides NOVO NORDISK HEALTHCARE AG 2010-01-13 CN disclosed
US-20090253166-A1 Conjugation of Peptides NOVO NORDISK A/S (DK) 2009-10-08 US disclosed
US-7524813-B2 Selectively conjugated peptides and methods of making the same NOVO NORDISK HEALTH CARE AG (CH) 2009-04-28 US disclosed
US-20090105134-A1 C-Terminally Pegylated Growth Hormones NOVO NORDISK A/S (DK) 2009-04-23 US disclosed
EP-1850878-A2 C-TERMINALLY PEGYLATED GROWTH HORMONES NOVO NORDISK A/S (DK) 2007-11-07 EP disclosed
US-20070111926-A1 Conjugation of peptides NOVO NORDISK A/S (DK) 2007-05-17 US disclosed
CN-1863920-A Conjugation of peptides NOVO NORDISK AS (DK) 2006-11-15 CN disclosed
WO-2006084888-A2 C-TERMINALLY PEGYLATED GROWTH HORMONES NOVO NORDISK A/S (DK) 2006-08-17 WO disclosed
EP-1673464-A2 CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2006-06-28 EP disclosed
WO-2005035553-A2 CONJUGATION OF PEPTIDES NOVO NORDISK A/S (DK) 2005-04-21 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-20090105134-A1 C-Terminally Pegylated Growth Hormones GHRHR, GHITM, HDGF NPC1 2911/4885RAB9A 3608/4885ALDH1A1 3531/4885
US-20070111926-A1 Conjugation of peptides DNPEP, ENPEP, ANPEP NPC1 3576/4885RAB9A 3236/4885ALDH1A1 2226/4885
US-20090253166-A1 Conjugation of Peptides DNPEP, ENPEP, ANPEP NPC1 3576/4885RAB9A 3236/4885ALDH1A1 2226/4885

“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.