SCHEMBL10793571

SCHEMBL10793571

CCOc1nc(N)nn1C(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.39
PDE1A P54750 6/20 0.36
PDE1B Q01064 6/20 0.36
PDE1C Q14123 6/20 0.36
SRC P12931 5/20 0.35
ABL1 P00519 4/20 0.35
HCK P08631 3/20 0.35
EGFR P00533 3/20 0.34
LCK P06239 1/20 0.34
EPHA3 P29320 1/20 0.34
CSK P41240 1/20 0.34
KCNH2 Q12809 1/20 0.32
PIK3CD O00329 2/20 0.32
KDR P35968 2/20 0.32
PIK3CA P42336 2/20 0.32
PIK3CB P42338 2/20 0.32
MTOR P42345 2/20 0.32
PIK3CG P48736 2/20 0.32
EPHB4 P54760 2/20 0.32
PRKDC P78527 2/20 0.32

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
SCHEMBL20159982 0.70 SCN4A (0.38) SRCABL1HCKEGFRKCNH2
SCHEMBL19772682 0.69 ADORA2A (0.32) ADORA2AADORA1
SCHEMBL12341466 0.67 L3MBTL1 (0.32) ADORA2AADORA1
SCHEMBL11967313 0.66 ADORA2A (0.30) ADORA2AADORA1
SCHEMBL20159730 0.63 MAP4K4 (0.39) SRCABL1HCKEGFRPIK3CD
SCHEMBL9604095 0.63
SCHEMBL16828155 0.60 SMN1; SMN2 (0.40) LMNASMN1; SMN2
SCHEMBL16828146 0.59 CDK1 (0.50) MEN1KMT2ALMNASMN1; SMN2
Hydrochloric Acid SCHEMBL16828217 0.59 SMN1; SMN2 (0.39) LMNASMN1; SMN2
SCHEMBL1576984 0.57 MEN1 (0.43) MEN1CYP1A2KMT2ALMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0103537-B1 N-ARYLSULFONYL-N'-TRIAZOLYL UREA CIBA-GEIGY AG (CH) 1987-07-08 EP disclosed
EP-0103537-A2 N-arylsulfonyl-N'-triazolyl urea CIBA-GEIGY AG (CH) 1984-03-21 EP disclosed