SCHEMBL445554

SCHEMBL445554

CCOC(=O)c1ccc(N2N=C(C(F)(F)F)C(=Cc3cccs3)C2=O)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.57
KAT8 Q9H7Z6 1/20 0.57
MAPT P10636 14/20 0.53
ALDH1A1 P00352 6/20 0.49
TDP1 Q9NUW8 5/20 0.49
L3MBTL1 Q9Y468 5/20 0.49
MAPK1 P28482 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
HPGD P15428 3/20 0.49
KDM4E B2RXH2 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
GAA P10253 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49
PKM P14618 1/20 0.49
SMN1; SMN2 Q16637 2/20 0.47
NPC1 O15118 1/20 0.47

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
SCHEMBL420954 1.00 EP300 (0.57) EP300KAT8MAPTALDH1A1TDP1
SCHEMBL447823 0.82 ERO1A (0.49) KAT8MAPTALDH1A1TDP1L3MBTL1
SCHEMBL420803 0.82 ERO1A (0.49) KAT8MAPTALDH1A1TDP1L3MBTL1
SCHEMBL31254773 0.69 MAPT (0.55) MAPTALDH1A1TDP1L3MBTL1MAPK1
SCHEMBL446711 0.68 KAT8 (0.60) EP300KAT8MAPTALDH1A1TDP1
SCHEMBL446710 0.68 KAT8 (0.60) EP300KAT8MAPTALDH1A1TDP1
SCHEMBL420802 0.68 KAT8 (0.60) EP300KAT8MAPTALDH1A1TDP1
SCHEMBL22219724 0.68 SMN1; SMN2 (0.45) ALDH1A1KMT2AKDM4ESMN1; SMN2NPC1
SCHEMBL29518176 0.67 MAPT (1.00) EP300KAT8MAPTALDH1A1TDP1
Ammonia Solution, Strong SCHEMBL8088133 0.66 MAPT (0.97) EP300KAT8MAPTALDH1A1TDP1

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 9 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
US-7645882-B2 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2010-01-12 US disclosed
US-20070123577-A1 Inhibitor of protein modification products formation TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2007-05-31 US disclosed
EP-1693369-A1 PROTEIN MODIFIER PRODUCTION INHIBITOR TOKAI UNIVERSITY EDUCATIONAL SYSTEM (JP) 2006-08-23 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 (3 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-20070123577-A1 Inhibitor of protein modification products formation SERPINB6, PROC, PLPBP EP300 1702/4885KAT8 2951/4885MAPT 3796/4885
US-20110028470-A1 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 EP300 3876/4885KAT8 2833/4885MAPT 4131/4885
US-20120065198-A2 Detection and Treatment of Schizophrenia GLO1, CBR1, AOX1 EP300 3876/4885KAT8 2833/4885MAPT 4131/4885

“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.