SCHEMBL443857

SCHEMBL443857

Cc1oc(-c2ccccc2)nc1CC(=O)N(Cc1ccc(C2SC(=O)NC2=O)cc1)c1cccc(C(=O)O)c1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
LTB4R2 Q9NPC1 1/20 0.39
PPARA Q07869 15/20 0.39
PPARG P37231 14/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36

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
SCHEMBL443664 0.81 CA2 (0.35) LTB4R2PPARAPPARGKMT2A
SCHEMBL445234 0.80 PTGES (0.48) LTB4R2MEN1KMT2A
SCHEMBL446132 0.78 LTB4R2 (0.45) LTB4R2PPARAPPARGPTGDR2KMT2A
SCHEMBL443207 0.78 HDAC1 (0.41) LTB4R2KMT2A
SCHEMBL446471 0.77 LTB4R2 (0.58) LTB4R2PTGDR2
SCHEMBL447866 0.77 LTB4R2 (0.41) KDM4ELTB4R2PPARAPPARGPTGDR2
SCHEMBL444612 0.76 CA2 (0.46) LTB4R2PPARAPPARGKMT2A
SCHEMBL446828 0.75 LTB4R2 (0.43) KDM4ELTB4R2KMT2A
SCHEMBL446224 0.75 GAA (0.53) KDM4ELTB4R2PTGDR2MEN1KMT2A
SCHEMBL445112 0.73 CA2 (0.41) LTB4R2PPARAPPARGMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140335517-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA RENASCIENCE CO LTD (JP) 2014-11-13 US disclosed
US-8809329-B2 Detection and treatment of schizophrenia TOKYO METROPOLITAN INSTITUTE OF MEDICAL SCIENCE (JP) 2014-08-19 US disclosed
EP-2662453-A2 Detection and treatment of schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2013-11-13 EP disclosed
US-20120065198-A2 Detection and Treatment of Schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2012-03-15 US disclosed
US-20110028470-A1 Detection and Treatment of Schizophrenia TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2011-02-03 US disclosed
EP-2189537-A1 DETECTION AND TREATMENT OF SCHIZOPHRENIA TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2010-05-26 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 (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-20110028470-A1 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 KDM4E 1357/4885LTB4R2 1275/4885PPARA 1766/4885
US-20120065198-A2 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 KDM4E 1357/4885LTB4R2 1275/4885PPARA 1766/4885

“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.