SCHEMBL13798157

SCHEMBL13798157

Bc1cc2nc(NC(=O)NCC)sc2cc1F

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 4/20 0.57
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
ABL1 P00519 11/20 0.56
PIK3CD O00329 1/20 0.50
PIK3CA P42336 1/20 0.48
PIK3CG P48736 1/20 0.48
DYRK1A Q13627 1/20 0.46

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
SCHEMBL6068056 0.88 NPC1 (0.57) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL13798160 0.86 NPC1 (0.59) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3661653 0.85 NPC1 (0.57) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL4496509 0.84 NPC1 (0.69) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL1685098 0.83 ABL1 (0.65) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL14824329 0.80 NPC1 (0.64) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3662009 0.78 ABL1 (0.53) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL12997528 0.78 NPC1 (0.49) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3664440 0.77 NPC1 (0.60) NPC1RAB9ASMN1; SMN2ABL1PIK3CD
SCHEMBL3662337 0.77 ABL1 (0.58) ABL1PIK3CD

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-2231653-B1 ANTIBACTERIAL CONDENSED THIAZOLES BIOTA EUROPE LTD (GB) 2013-04-03 EP disclosed
WO-2009074812-A1 ANTIBACTERIAL CONDENSED THIAZOLES PROLYSIS LTD (GB) 2009-06-18 WO disclosed