SCHEMBL5429419

SCHEMBL5429419

O=C(O)c1ccc2[nH]cc(-c3c[nH]c4ccccc34)c2c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 2/20 0.61
BRD4 O60885 1/20 0.54
HTR7 P34969 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
KDM4E B2RXH2 1/20 0.48
MAPT P10636 1/20 0.48
PDE10A Q9Y233 1/20 0.48
GPR84 Q9NQS5 2/20 0.47
PRKD3 O94806 1/20 0.46
CCNB2 O95067 1/20 0.46
CCNE2 O96020 1/20 0.46
ABL1 P00519 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46
CDK1 P06493 1/20 0.46
PIM1 P11309 1/20 0.46
CDK4 P11802 1/20 0.46
CCNB1 P14635 1/20 0.46
PRKCA P17252 1/20 0.46

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
SCHEMBL5424839 0.90 PTPN1 (0.61) PTPN1BRD4HTR7NPC1RAB9A
SCHEMBL29221014 0.87 PTPN1 (0.61) PTPN1HTR7ASH1L
SCHEMBL29221042 0.87 PTPN1 (0.58) PTPN1BRD4HTR7NPC1RAB9A
SCHEMBL13302236 0.86 HTR1A (0.55) PTPN1HTR7MEN1KMT2AASH1L
SCHEMBL16509551 0.86 MEN1 (0.52) PTPN1BRD4HTR7NPC1RAB9A
SCHEMBL29221024 0.85 PTPN1 (0.60) PTPN1HTR7NPC1RAB9AKDM4E
SCHEMBL29221058 0.85 PTPN1 (0.60) PTPN1HTR7PIM1
SCHEMBL29221047 0.84 PTPN1 (0.62) PTPN1HTR7
SCHEMBL5426730 0.84 PTPN1 (0.54) PTPN1HTR7KDM4EMAPTKMT2A
SCHEMBL13302375 0.83 PTPN1 (0.51) PTPN1BRD4HTR7NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1893576-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2008-03-05 EP claimed
US-20070015813-A1 Treatment of protein folding disorders QUEEN'S UNIVERSITY AT KINGSTON (CA) 2007-01-18 US claimed
WO-2006125324-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2006-11-30 WO claimed
US-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-8362066-B2 Compounds and methods for treating protein folding disorders TREVENTIS CORPORATION (US) 2013-01-29 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
US-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2010-06-10 US disclosed
EP-1893576-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2008-03-05 EP disclosed
US-20070015813-A1 Treatment of protein folding disorders QUEEN'S UNIVERSITY AT KINGSTON (CA) 2007-01-18 US disclosed
WO-2006125324-A1 TREATMENT OF PROTEIN FOLDING DISORDERS QUEEN'S UNIVERSITY AT KINGSTON (CA) 2006-11-30 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-20100144821-A1 COMPOUNDS AND METHODS FOR TREATING PROTEIN FOLDING DISORDERS SNCA, MAPT, APP PTPN1 4116/4885BRD4 521/4885HTR7 2988/4885
US-20070015813-A1 Treatment of protein folding disorders HSPA5, TTR, TUFM PTPN1 4634/4885BRD4 509/4885HTR7 1505/4885

“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.