SCHEMBL443448

SCHEMBL443448

CCCCS(=O)(=O)N(Cc1ccc(C2SC(=O)NC2=O)cc1)c1cccc(C(=O)O)c1

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.40
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
LTB4R2 Q9NPC1 2/20 0.39
CA2 P00918 1/20 0.38
PPARG P37231 5/20 0.38
PPARD Q03181 2/20 0.38
PPARA Q07869 2/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 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
SCHEMBL446829 0.92 GRM2 (0.38) GRM2CA2PPARGPPARDPPARA
SCHEMBL446076 0.89 CA2 (0.47) GRM2ALDH1A1CA2PPARGPPARD
SCHEMBL447265 0.87 ALDH1A1 (0.43) ALDH1A1LMNACA2MEN1KMT2A
SCHEMBL446213 0.86 ALDH1A1 (0.46) GRM2ALDH1A1LMNACA2PPARG
SCHEMBL444342 0.83 LMNA (0.57) ALDH1A1LMNACA2MEN1KMT2A
SCHEMBL443421 0.83 LTB4R2 (0.41) LTB4R2CA2PPARGPPARDPPARA
SCHEMBL445377 0.82 PTGES (0.51) ALDH1A1LMNAMEN1KMT2A
SCHEMBL446471 0.82 LTB4R2 (0.58) LTB4R2
SCHEMBL446371 0.80 ALOX5 (0.53) ALDH1A1LMNAMEN1KMT2A
SCHEMBL448085 0.79 ALDH1A1 (0.52) ALDH1A1LMNACA2MEN1KMT2A

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 GRM2 196/4885ALDH1A1 240/4885LMNA 4046/4885
US-20120065198-A2 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 GRM2 196/4885ALDH1A1 240/4885LMNA 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.