SCHEMBL4393433

SCHEMBL4393433

Cc1ccccc1-n1c(CCl)nc2ccccc2c1=O

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.68
LMNA P02545 3/20 0.68
L3MBTL1 Q9Y468 2/20 0.68
PDE10A Q9Y233 1/20 0.63
KDM4E B2RXH2 2/20 0.62
MAPT P10636 2/20 0.62
HPGD P15428 1/20 0.62
PDE7A Q13946 1/20 0.57
SMN1; SMN2 Q16637 2/20 0.56
PDE4D Q08499 1/20 0.56
GAA P10253 1/20 0.55
PKM P14618 1/20 0.55
HTT P42858 1/20 0.55
KMT2A Q03164 2/20 0.53
PIK3CD O00329 1/20 0.53
TP53 P04637 2/20 0.53
MEN1 O00255 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
SCHEMBL11435540 0.89 L3MBTL1 (0.71) ALDH1A1LMNAL3MBTL1PDE10AKDM4E
SCHEMBL11784878 0.86 PDE4D (0.73) ALDH1A1LMNAL3MBTL1PDE10AKDM4E
SCHEMBL11435535 0.85 ALDH1A1 (0.74) ALDH1A1LMNAL3MBTL1PDE10AKDM4E
SCHEMBL735504 0.85 PIK3CD (0.73) ALDH1A1LMNAL3MBTL1PDE10AKDM4E
SCHEMBL4393532 0.84 ALDH1A1 (0.63) ALDH1A1LMNAL3MBTL1KDM4EHPGD
SCHEMBL4393442 0.83 L3MBTL1 (0.79) ALDH1A1LMNAL3MBTL1MAPTKMT2A
SCHEMBL1703503 0.82 ALDH1A1 (0.70) ALDH1A1LMNAL3MBTL1PDE10AKDM4E
SCHEMBL733511 0.82 PIK3CD (0.61) ALDH1A1LMNAL3MBTL1PDE10AKDM4E
SCHEMBL4394259 0.81 NPC1 (0.70) ALDH1A1LMNAKDM4EMAPTHPGD
Methaqualone SCHEMBL43892 0.81 ALDH1A1 (1.00) ALDH1A1LMNAL3MBTL1MAPTPDE7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8829014-B2 Thiazole and thiophene analogues, and their use in treating autoimmune diseases and cancers BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2014-09-09 US disclosed
EP-2007393-B1 THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS UNIV LOUISIANA STATE (US) 2013-08-21 EP disclosed
US-20120283268-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers GIORDANO ANTHONY (US) 2012-11-08 US disclosed
US-8217037-B2 Thiazole and thiophene analogues, and their use in treating autoimmune diseases and cancers BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE (US) 2012-07-10 US disclosed
US-20090306073-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers B.V. PATEL PHARMACEUTICAL EDUCATION & RESEARCH DEVELOPMENT (PERD) CENTRE (IN) 2009-12-10 US disclosed
EP-2007393-A2 THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS Board Of Supervisors Of Louisiana State University And Agricultural And Mechanical College (US) 2008-12-31 EP disclosed
WO-2007118149-A2 THIAZOLE AND THIOPHENE ANALOGUES, AND THEIR USE IN TREATING AUTOIMMUNE DISEASES AND CANCERS BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL LOLLEGE (US) 2007-10-18 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-20090306073-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers TPMT, TST, SSB ALDH1A1 760/4885LMNA 4878/4885L3MBTL1 2304/4885
US-20120283268-A1 Thiazole and Thiophene Analogues, and Their Use in Treating Autoimmune Diseases and Cancers TPMT, TST, SSB ALDH1A1 760/4885LMNA 4878/4885L3MBTL1 2304/4885

“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.