SCHEMBL5828481

SCHEMBL5828481

CN(C)CCNC(=O)CN

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 2/20 0.53
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
LGALS1 P09382 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
ACKR3 P25106 1/20 0.40
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPK1 P28482 1/20 0.39
PRMT3 O60678 1/20 0.39
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
PRMT1 Q99873 1/20 0.39
PRMT8 Q9NR22 1/20 0.39
CASP2 P42575 1/20 0.38

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
Hydrochloric Acid SCHEMBL56355 0.98 DNM1 (0.52) DNM1CA1CA2CA12CA9
Hydrochloric Acid SCHEMBL4913273 0.85 DNM1 (0.56) DNM1CYP2C9CYP2C19ALDH1A1HTT
SCHEMBL3550114 0.83 DNM1 (0.59) DNM1CA1CA2CA12CA9
SCHEMBL7345247 0.82 DNM1 (0.53) DNM1CA1CA2CA12CA9
SCHEMBL23562968 0.81 CA2 (0.39) DNM1CA1CA2CA12CA9
SCHEMBL13584322 0.81 DNM1 (0.57) DNM1CA1CA2CA12CA9
Hydrochloric Acid SCHEMBL55352 0.81 DNM1 (0.58) DNM1CA1CA2CA12CA9
SCHEMBL3633164 0.80 DNM1 (0.52) DNM1CA1CA2CA12CA9
SCHEMBL28034533 0.79 DNM1 (0.66) DNM1CA1CA2CA12CA9
Hydrochloric Acid SCHEMBL20509033 0.79 CYP3A4 (0.39) DNM1CA1CA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11084842-B2 Glucopyranosyl derivative and use thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-08-10 US disclosed
US-20210061839-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2021-03-04 US disclosed
WO-2019144864-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2019-08-01 WO disclosed
CN-101883774-A Thienopyrimidine and pyrazolopyrimidine compounds and their use as MTOR kinase and PI3 kinase inhibitors WYETH CORP 2010-11-10 CN disclosed
US-7001904-B1 Guanidine derivatives quinazoline and quinoline for use in the treatment of autoimmune diseases ASTRAZENECA AB (SE) 2006-02-21 US disclosed
EP-1296973-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES AstraZeneca AB (SE) 2003-04-02 EP disclosed
WO-2002000644-A1 GUANIDINE DERIVATIVES OF QUINAZOLINE AND QUINOLINE FOR USE IN THE TREATMENT OF AUTOIMMUNE DISEASES ASTRAZENECA AB (SE) 2002-01-03 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 (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-20210061839-A1 GLUCOPYRANOSYL DERIVATIVE AND USE THEREOF SLC5A1, SLC5A2, UGGT1 DNM1 2343/4885CA1 3420/4885CA2 977/4885
US-11084842-B2 Glucopyranosyl derivative and use thereof SLC5A1, SLC5A2, UGGT1 DNM1 2343/4885CA1 3420/4885CA2 977/4885

“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.