SCHEMBL446076

SCHEMBL446076

CCCCS(=O)(=O)N(Cc1ccc(C2SC(=O)NC2=O)cc1)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.47
PPARG P37231 8/20 0.41
HIF1A Q16665 1/20 0.40
EPAS1 Q99814 1/20 0.40
CNR2 P34972 2/20 0.37
PPARD Q03181 3/20 0.37
PPARA Q07869 3/20 0.37
GRM2 Q14416 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ESR1 P03372 1/20 0.34

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
SCHEMBL443448 0.89 GRM2 (0.40) CA2PPARGPPARDPPARAGRM2
SCHEMBL446829 0.86 GRM2 (0.38) CA2PPARGCNR2PPARDPPARA
SCHEMBL443636 0.85 CA2 (0.54) CA2PPARGPPARDPPARATSHR
SCHEMBL446213 0.75 ALDH1A1 (0.46) CA2PPARGPPARDPPARAGRM2
SCHEMBL443421 0.71 LTB4R2 (0.41) CA2PPARGCNR2PPARDPPARA
SCHEMBL446471 0.71 LTB4R2 (0.58)
SCHEMBL446347 0.70 CA2 (0.46) CA2CNR2ALDH1A1ESR1
SCHEMBL445377 0.69 PTGES (0.51) CNR2ALDH1A1
SCHEMBL446371 0.69 ALOX5 (0.53) ALDH1A1
SCHEMBL13762633 0.68 GRM2 (0.60) CNR2GRM2TSHRHTTL3MBTL1

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 CA2 2650/4885PPARG 857/4885HIF1A 2858/4885
US-20120065198-A2 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 CA2 2650/4885PPARG 857/4885HIF1A 2858/4885

“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.