SCHEMBL10722285

SCHEMBL10722285

CC(C)(C)Nc1nc(NC(C)(C)C)nc(NC(C)(CO)CO)n1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
MAPT P10636 1/20 0.52
PDE4A P27815 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP2C19 P33261 2/20 0.45
ALDH1A1 P00352 3/20 0.43
KMT2A Q03164 3/20 0.43
NPSR1 Q6W5P4 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 2/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
GAA P10253 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
SCHEMBL16005657 0.93 NPSR1 (0.44) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL16005728 0.83 SMN1; SMN2 (0.39) LMNASMN1; SMN2MAPTPDE4AALDH1A1
SCHEMBL10726504 0.82 LMNA (0.52) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL10721484 0.82 NPSR1 (0.58) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL10619199 0.80 SMN1; SMN2 (0.74) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL16005423 0.78 MEN1 (0.39) SMN1; SMN2MAPTPDE4ACYP1A2KMT2A
SCHEMBL10721766 0.74 LMNA (0.48) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL16005592 0.71 NPSR1 (0.43) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL14438979 0.70 PDE4A (0.78) LMNASMN1; SMN2MAPTPDE4ACYP1A2
SCHEMBL19687642 0.70 LMNA (0.68) LMNASMN1; SMN2MAPTPDE4ACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240854-A1 Bis-tert-butylamino-substituted 1,3,5-triazine derivatives, process for their preparation, medicaments containing these compounds, and their use HOECHST AKTIENGESELLSCHAFT (DE) 1987-10-14 EP disclosed