SCHEMBL10244775

SCHEMBL10244775

Nc1nc(CS)nc(O)c1N=O

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
CDK2 P24941 4/20 0.36
CDK1 P06493 3/20 0.36
CDK4 P11802 1/20 0.36
CCNA2 P20248 3/20 0.34
CCNA1 P78396 3/20 0.34
CCNB1 P14635 2/20 0.31
MGMT P16455 2/20 0.31

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
SCHEMBL4458085 0.86 MAPT (0.44) MAPTTDP1CDK2CDK1CDK4
SCHEMBL5026853 0.76 CDK2 (0.38) MAPTCDK2CDK1CDK4CCNA2
SCHEMBL29693584 0.75 CDK2 (0.41) MAPTTDP1CDK2CDK1CDK4
SCHEMBL4160357 0.75 CDK2 (0.52) MAPTTDP1CDK2CDK1CDK4
SCHEMBL29473573 0.75 CDK2 (0.52) MAPTTDP1CDK2CDK1CDK4
SCHEMBL2745214 0.75 CDK2 (0.41) MAPTTDP1CDK2CDK1CDK4
SCHEMBL8990633 0.75 CDK1 (0.47) MAPTCDK2CDK1CCNA2CCNA1
SCHEMBL19398338 0.74 MAPT (0.46) MAPTTDP1
SCHEMBL6402248 0.72 CDK2 (0.40) MAPTCDK2CDK1CDK4CCNA2
SCHEMBL10441417 0.72 CDK2 (0.38) MAPTCDK2CDK1CDK4CCNA2

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-20170275287-A1 NOVEL N2, N4, N7, 6-TETRASUBSTITUTED PTERIDINE-2,4,7-TRIAMINE AND 2, 4, 6, 7-TETRASUBSTITUTED PTERIDINE COMPOUNDS AND METHODS OF SYNTHESIS AND USE THEREOF JANUS BIOTHERAPEUTICS, INC. (US) 2017-09-28 US disclosed
US-9221822-B2 Thiazolopyrimidine modulators as immunosuppressive agents KATHOLIEKE UNIVERSITEIT LEUVEN, K. U. LEUVEN R&D (BE) 2015-12-29 US disclosed
US-20150038494-A1 Thiazolopyrimidine Modulators as Immunosuppressive Agents KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2015-02-05 US disclosed
US-8901132-B2 Thiazolopyrimidine modulators as immunosuppressive agents KATHOLIEKE UNIVERSITEIT LEUVEN, K.U. LEUVEN R&D (BE) 2014-12-02 US disclosed
US-20120046278-A1 THIAZOLOPYRIMIDINE MODULATORS AS IMMUNOSUPPRESSIVE AGENTS KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2012-02-23 US disclosed
WO-2010103130-A2 NOVEL BICYCLIC HETEROCYCLES KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2010-09-16 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 (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-20150038494-A1 Thiazolopyrimidine Modulators as Immunosuppressive Agents TPMT, STAT6, IL4 MAPT 3520/4885TDP1 914/4885CDK2 440/4885
US-20120046278-A1 THIAZOLOPYRIMIDINE MODULATORS AS IMMUNOSUPPRESSIVE AGENTS TPMT, STAT6, IL4 MAPT 3520/4885TDP1 914/4885CDK2 440/4885
US-20170275287-A1 NOVEL N2, N4, N7, 6-TETRASUBSTITUTED PTERIDINE-2,4,7-TRIAMINE AND 2, 4, 6, 7-TETRASUBSTITUTED PTERIDINE COMPOUNDS AND METHODS OF SYNTHESIS AND USE THEREOF TLR7, C5, CD4 MAPT 2673/4885TDP1 1142/4885CDK2 355/4885

“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.