SCHEMBL4007077

SCHEMBL4007077

Nc1ccc(/C=C/c2nc3ccccc3o2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.59
NPC1 O15118 4/20 0.59
RAB9A P51151 4/20 0.59
KMT2A Q03164 4/20 0.59
SNCA P37840 1/20 0.57
HDAC3 O15379 1/20 0.54
HDAC4 P56524 1/20 0.54
HDAC1 Q13547 1/20 0.54
HDAC7 Q8WUI4 1/20 0.54
HDAC2 Q92769 1/20 0.54
HDAC10 Q969S8 1/20 0.54
HDAC11 Q96DB2 1/20 0.54
HDAC8 Q9BY41 1/20 0.54
HDAC6 Q9UBN7 1/20 0.54
HDAC9 Q9UKV0 1/20 0.54
HDAC5 Q9UQL6 1/20 0.54
KDM4E B2RXH2 2/20 0.53
ALDH1A1 P00352 2/20 0.53
HPGD P15428 2/20 0.53
MAPT P10636 1/20 0.53

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
SCHEMBL4007081 1.00 MEN1 (0.59) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL156861 0.86 SNCA (0.64) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL61657 0.86 SNCA (0.64) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL6421503 0.84 SNCA (0.64) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL6421501 0.84 SNCA (0.64) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL6492602 0.84 MEN1 (0.59) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL708951 0.84 NPC1 (0.63) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL6479879 0.84 MEN1 (0.69) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL22360047 0.84 MEN1 (0.63) MEN1NPC1RAB9AKMT2ASNCA
SCHEMBL6607138 0.84 MEN1 (0.63) MEN1NPC1RAB9AKMT2ASNCA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893245-A4 RADIOLABELED-PEGYLATION OF LIGANDS FOR USE AS IMAGING AGENTS UNIV PENNSYLVANIA (US) 2009-06-24 EP disclosed
EP-1893245-A2 RADIOLABELED-PEGYLATION OF LIGANDS FOR USE AS IMAGING AGENTS The Trustees of the University of Pennsylvania (US) 2008-03-05 EP disclosed
US-20070031328-A1 Radiolabeled-pegylation of ligands for use as imaging agents NATIONAL INSTITUTES OF HEALTH - DIRECTOR DEITR 2007-02-08 US disclosed
WO-2007002540-A2 RADIOLABELED-PEGYLATION OF LIGANDS FOR USE AS IMAGING AGENTS KUNG HANK F (US) 2007-01-04 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 (1 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-20070031328-A1 Radiolabeled-pegylation of ligands for use as imaging agents EGFR, LANCL1, FLT1 MEN1 1380/4885NPC1 935/4885RAB9A 1417/4885

“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.