SCHEMBL13731191

SCHEMBL13731191

NC(=O)CCCCNC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 1/20 0.48
ADRA1A P35348 1/20 0.45
MAPK1 P28482 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HIF1A Q16665 1/20 0.39
PLA2G2A P14555 1/20 0.37
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
PAOX Q6QHF9 2/20 0.37
POLB P06746 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CASP2 P42575 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL28945607 0.98 PRMT1 (0.52) PRMT1ADRA1AMAPK1KDM4EHIF1A
SCHEMBL27130042 0.98 PRMT1 (0.52) PRMT1ADRA1AMAPK1KDM4EHIF1A
SCHEMBL25575179 0.89 CASP2 (0.47) PRMT1ADRA1AALDH1A1SMN1; SMN2CASP2
SCHEMBL3651893 0.84
SCHEMBL3174690 0.84 KDM4E (0.50) PRMT1ADRA1AMAPK1KDM4EHIF1A
SCHEMBL29916467 0.82 PRMT1 (0.70) PRMT1ADRA1AMAPK1PLA2G2ALMNA
SCHEMBL19683940 0.82 PRMT1 (0.44) PRMT1ADRA1AMAPK1KDM4EHIF1A
SCHEMBL453216 0.81 KDM4E (0.55) PRMT1ADRA1AMAPK1KDM4EHIF1A
SCHEMBL28569684 0.81 KDM4E (0.55) PRMT1ADRA1AMAPK1KDM4EHIF1A
SCHEMBL20836564 0.81 KDM4E (0.55) PRMT1ADRA1AMAPK1KDM4EHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9487492-B2 Dibenzothiazepine derivatives and their use in the treatment of CNS disorders NUMEDICUS LIMITED (GB) 2016-11-08 US disclosed
EP-2699559-B1 DIBENZOTHIAZEPINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS NUMEDICUS LTD (GB) 2016-04-06 EP disclosed
US-20140243317-A1 DIBENZOTHIAZEPINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS NUMEDICUS LIMITED (GB) 2014-08-28 US disclosed
EP-2699559-A1 DIBENZOTHIAZEPINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS Numedicus Limited (GB) 2014-02-26 EP disclosed
WO-2012143703-A1 DIBENZOTHIAZEPINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS NUMEDICUS LIMITED (GB) 2012-10-26 WO 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 (1 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-20140243317-A1 DIBENZOTHIAZEPINE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CNS DISORDERS SLC6A3, DRD1, AVPR2 PRMT1 928/4885ADRA1A 249/4885MAPK1 2032/4885

“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.