SCHEMBL13634348

SCHEMBL13634348

CCCO[C@H]1CCN(c2nc(C(=O)O)co2)C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 8/20 0.41
LIPC P11150 2/20 0.41
TAAR1 Q96RJ0 1/20 0.40
TTR P02766 2/20 0.38
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
NPC1 O15118 4/20 0.36
RAB9A P51151 4/20 0.36
HSD11B1 P28845 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
HCRTR1 O43613 1/20 0.33
HCRTR2 O43614 1/20 0.33
ACACB O00763 1/20 0.33
LPL P06858 1/20 0.33

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
SCHEMBL13162581 0.91 TTR (0.39) LIPGLIPCTTRHSD11B1IRAK4
SCHEMBL13638873 0.90 LIPG (0.46) LIPGLIPCTTRIRAK4ACACB
SCHEMBL13634332 0.84 SCD5 (0.39) TTRIRAK4ACACB
SCHEMBL3436269 0.83 HCRTR1 (0.35) LIPGTTRLMNAIRAK4HCRTR1
SCHEMBL20801175 0.80 ADORA2A (0.39) TTRIRAK4
SCHEMBL15888574 0.79 HCRTR1 (0.42) LIPGLIPCIRAK4HCRTR1HCRTR2
SCHEMBL20801224 0.79 IRAK4 (0.39) TTRIRAK4
SCHEMBL15888551 0.79 HCRTR1 (0.44) TTRLMNANPC1RAB9AIRAK4
SCHEMBL16896321 0.79 TTR (0.36) LIPGTTRIRAK4HCRTR1HCRTR2
SCHEMBL18207856 0.79 TTR (0.36) LIPGTTRIRAK4HCRTR1HCRTR2

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
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed