SCHEMBL445377

SCHEMBL445377

Cc1ccc(S(=O)(=O)N(Cc2ccc(C3SC(=O)NC3=O)cc2)c2cccc(C(=O)O)c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGES O14684 4/20 0.51
ALOX5 P09917 3/20 0.51
LMNA P02545 2/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 3/20 0.46
MAPT P10636 2/20 0.45
CNR2 P34972 4/20 0.45
CNR1 P21554 3/20 0.45
MEN1 O00255 2/20 0.44
TAS2R14 Q9NYV8 2/20 0.44
MCL1 Q07820 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41

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
SCHEMBL444342 0.93 LMNA (0.57) PTGESALOX5LMNAALDH1A1KMT2A
SCHEMBL446371 0.91 ALOX5 (0.53) PTGESALOX5LMNAALDH1A1KMT2A
SCHEMBL448085 0.88 ALDH1A1 (0.52) PTGESALOX5LMNAALDH1A1KMT2A
SCHEMBL446066 0.87 PTGES (0.42) PTGESALOX5LMNAALDH1A1KMT2A
SCHEMBL447265 0.87 ALDH1A1 (0.43) LMNAALDH1A1KMT2AMAPTMEN1
SCHEMBL446213 0.83 ALDH1A1 (0.46) LMNAALDH1A1KMT2AMEN1
SCHEMBL443448 0.82 GRM2 (0.40) LMNAALDH1A1KMT2AMEN1
SCHEMBL444121 0.78 MCL1 (0.49) PTGESALOX5LMNAALDH1A1KMT2A
SCHEMBL444612 0.76 CA2 (0.46) PTGESALOX5LMNAALDH1A1KMT2A
SCHEMBL446471 0.75 LTB4R2 (0.58)

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 PTGES 514/4885ALOX5 359/4885LMNA 4046/4885
US-20120065198-A2 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 PTGES 514/4885ALOX5 359/4885LMNA 4046/4885

“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.