SCHEMBL3609002

SCHEMBL3609002

N=C(N)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CFTR P13569 2/20 0.60
CSNK2A2 P19784 1/20 0.57
CSNK2B P67870 1/20 0.57
CSNK2A1 P68400 1/20 0.57
CSNK2A3 Q8NEV1 1/20 0.57
MAPT P10636 7/20 0.55
MAPK1 P28482 2/20 0.55
SIRT5 Q9NXA8 1/20 0.54
VCP P55072 1/20 0.53
MPL P40238 1/20 0.52
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
KDM4E B2RXH2 5/20 0.51
TRPA1 O75762 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ALDH1A1 P00352 1/20 0.50
TRPV3 Q8NET8 1/20 0.50
TRPV4 Q9HBA0 1/20 0.50
ADAM17 P78536 1/20 0.50
POLB P06746 1/20 0.50

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
SCHEMBL3599413 0.84 GSTO1 (0.63) CSNK2A2CSNK2BCSNK2A1CSNK2A3MAPT
SCHEMBL30660069 0.83 MEN1 (0.58) CFTRMAPTMAPK1SIRT5VCP
SCHEMBL28484317 0.83 MEN1 (0.58) CFTRMAPTMAPK1SIRT5VCP
SCHEMBL28911477 0.83 CFTR (0.60) CFTRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL30118262 0.83 CFTR (0.60) CFTRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL18724400 0.82 ABL1 (0.69) CFTRCSNK2A2CSNK2BCSNK2A1CSNK2A3
SCHEMBL3615155 0.82 ALOX5 (0.51) MAPTVCPMEN1KMT2ANPSR1
SCHEMBL11090239 0.82 MAPT (0.51) MAPTVCPMEN1KMT2ANPSR1
SCHEMBL3602570 0.82 ABL1 (0.67) CFTRSIRT5VCPALDH1A1
SCHEMBL2393684 0.82 HDAC3 (0.59) MAPTVCPMEN1KMT2ANPSR1

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-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US claimed
CN-101466692-A Thiazol-guanidine derivatives useful as a (beta) - related pathologies ASTRAZENECA AB (SE) 2009-06-24 CN claimed
EP-2010508-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES AstraZeneca AB (SE) 2009-01-07 EP claimed
WO-2007120096-A1 THIAZOL-GUANIDINE DERIVATIVES USEFUL AS A (BETA)- RELATED PATHOLOGIES ASTRAZENECA AB (SE) 2007-10-25 WO claimed
US-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies ASTRAZENECA AB (SE) 2010-11-25 US disclosed
CN-101466692-A Thiazol-guanidine derivatives useful as a (beta) - related pathologies ASTRAZENECA AB (SE) 2009-06-24 CN 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-20100298340-A1 Thiazol-Guanidine Derivatives Useful As A (Beta)-Related Pathologies GRN, MAPT, GUCY1B1 CFTR 1763/4885CSNK2A2 1615/4885CSNK2B 1210/4885

“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.