SCHEMBL905288

SCHEMBL905288

O=c1[nH]c(-c2ccccn2)co1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.50
KDM4E B2RXH2 7/20 0.50
NPC1 O15118 6/20 0.50
RAB9A P51151 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 3/20 0.50
BTK Q06187 1/20 0.46
POLB P06746 2/20 0.45
HIF1A Q16665 2/20 0.45
CCR1 P32246 2/20 0.45
CCR5 P51681 2/20 0.45
CCR8 P51685 2/20 0.45
METAP1 P53582 2/20 0.45
CYP1A2 P05177 1/20 0.45
BLM P54132 1/20 0.45
DOHH Q9BU89 1/20 0.45
P4HTM Q9NXG6 1/20 0.45
PSMB8 P28062 1/20 0.44
CCNB2 O95067 1/20 0.44

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
SCHEMBL29624537 0.72 KDM4E (0.62) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1456454 0.72 KDM4E (0.62) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL20510086 0.72 KDM4E (0.50) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1988750 0.72 KDM4E (0.58) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL297366 0.71 NOTUM (0.47) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL5709792 0.70 NOTUM (0.52) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL29664837 0.70 NOTUM (0.52) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL1456955 0.70 KDM4E (0.59) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL7536764 0.69 BTK (0.51) LMNAKDM4ENPC1RAB9ASMN1; SMN2
SCHEMBL24625410 0.67 KDM4E (0.68) LMNAKDM4ENPC1RAB9ASMN1; 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 82 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1585751-A4 PEPTIDE DEFORMYLASE ACTIVATED PRODRUGS CELMED ONCOLOGY USA INC (CA) 2008-08-13 EP claimed
JP-2006514009-A 2006-04-27 JP claimed
US-20060063743-A1 Peptide deformylase activated prodrugs BALLATORE CARLO 2006-03-23 US claimed
EP-1585751-A2 PEPTIDE DEFORMYLASE ACTIVATED PRODRUGS Celmed Oncology (USA), Inc. (CA) 2005-10-19 EP claimed
US-20040236096-A1 Peptide deformylase activated prodrugs NEWBIOTICS, INC. 2004-11-25 US claimed
WO-2004043400-A2 PEPTIDE DEFORMYLASE ACTIVATED PRODRUGS CELMED ONCOLOGY (USA), INC. (CA) 2004-05-27 WO claimed
US-5955100-A TREATMENT OF MALIGNANT TUMORS, INFLAMMATORY DISEASES, OR AUTOIMMUNE DISEASES BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1999-09-21 US claimed
EP-0879605-A2 GLYCOSYL PRODRUG CONJUGATE WITH ENHANCED TOLERANCE HOECHST AKTIENGESELLSCHAFT (DE) 1998-11-25 EP claimed
US-5621002-A HAVING A MODIFIED COMPETITIVE ENZYME ACTIVITY INHBITOR LINKED TO A SPACER-DRUG; ENZYME CLEAVAGE AT A LOWER CONCENTRATION, I.E. LOW MICHAELIS-MENTEN CONSTANT(KM) BEHRINGWERKE AKTIENGESELLSCHAFT (DE) 1997-04-15 US claimed
EP-0647450-A1 Improved prodrugs for enzyme mediated activation BEHRINGWERKE Aktiengesellschaft (DE) 1995-04-12 EP claimed
EP-0642799-A1 Improved prodrugs for enzyme mediated activation BEHRINGWERKE Aktiengesellschaft (DE) 1995-03-15 EP claimed
EP-0595133-A2 Prodrugs, their preparation and use as medicaments BEHRINGWERKE Aktiengesellschaft (DE) 1994-05-04 EP claimed
JP-3170426-A None JP disclosed
JP-3170427-A None JP disclosed
US-20110300147-A9 Inhibiting tumor cell invasion, metastasis and angiogenesis THE SCRIPPS RESEARCH INSTITUTE (US) 2011-12-08 US disclosed
EP-0595133-B1 Prodrugs, their preparation and use as medicaments SANOFI AVENTIS DEUTSCHLAND (DE) 2011-01-05 EP disclosed
EP-0428103-A2 Prevention of glycoprotein enveloped virus infectivity by pyridyloxazole-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1991-05-22 EP disclosed
EP-0428103-A2 Prevention of glycoprotein enveloped virus infectivity by pyridyloxazole-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1991-05-22 EP disclosed
EP-0428103-A2 Prevention of glycoprotein enveloped virus infectivity by pyridyloxazole-2-ones MERRELL DOW PHARMACEUTICALS INC. (US) 1991-05-22 EP disclosed
EP-0428106-A1 Novel pyridyloxazole 2-ones useful as proteinkinase C inhibitors MERRELL DOW PHARMACEUTICALS INC. (US) 1991-05-22 EP 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-20060063743-A1 Peptide deformylase activated prodrugs DNPEP, DPEP1, PEPD LMNA 3916/4885KDM4E 2784/4885NPC1 2823/4885
US-20040236096-A1 Peptide deformylase activated prodrugs DNPEP, DPEP1, PEPD LMNA 3978/4885KDM4E 2746/4885NPC1 2399/4885
US-20110300147-A9 Inhibiting tumor cell invasion, metastasis and angiogenesis MMP9, TIMP3, MMP3 LMNA 3944/4885KDM4E 3077/4885NPC1 1768/4885

“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.