SCHEMBL8075835

SCHEMBL8075835

CSc1nc(NCc2ccccc2)nc(NCc2ccccc2)n1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.61
HSD17B10 Q99714 1/20 0.61
KCNH3 Q9ULD8 2/20 0.56
GAA P10253 1/20 0.56
PPARG P37231 3/20 0.50
LMNA P02545 1/20 0.50
RAD52 P43351 1/20 0.49
HTT P42858 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
SCHEMBL3298289 0.84 KCNH3 (0.73) KCNH3GAALMNARAD52
SCHEMBL18062211 0.80 SMN1; SMN2 (0.46) SMN1; SMN2HSD17B10GAAPPARGLMNA
SCHEMBL8070572 0.80 RAB9A (0.54) SMN1; SMN2HSD17B10KCNH3GAALMNA
SCHEMBL14869398 0.79 BCHE (0.65) KCNH3GAALMNARAD52
SCHEMBL13194932 0.79 APP (0.68) SMN1; SMN2KCNH3GAALMNARAD52
SCHEMBL3459285 0.77 LMNA (0.56) SMN1; SMN2HSD17B10GAALMNAHTT
SCHEMBL3459282 0.76 SMN1; SMN2 (0.51) SMN1; SMN2HSD17B10GAAPPARGLMNA
SCHEMBL12321866 0.76 MEN1 (0.53) SMN1; SMN2HSD17B10GAAPPARGLMNA
SCHEMBL3461164 0.75 HTT (0.60) SMN1; SMN2GAALMNAHTT
SCHEMBL11788237 0.75 KCNH3 (0.61) KCNH3GAALMNARAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0648755-B1 Improved process for the preparation of 2,4-di(alkylamino)-6-alkylthio-s-triazines and 2-alkylamino-4,6-di(alkylthio)-s-triazines CIBA SC HOLDING AG (CH) 2000-08-02 EP disclosed
US-5420274-A Process for the preparation of 2,4-di(alkylamino)-6-alkylthio-s-triazines CIBA-GEIGY CORPORATION (US) 1995-05-30 US disclosed
EP-0648755-A1 Improved process for the preparation of 2,4-Di(alkylamino)-6-alkylthio-s-triazines CIBA-GEIGY AG (CH) 1995-04-19 EP disclosed