SCHEMBL3476362

SCHEMBL3476362

c1cc2oncc2cc1-c1ccc2oc(NC3CCCCC3)nc2c1

nearest known ligand 0.65

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.65
HDAC6 Q9UBN7 2/20 0.57
PIK3CA P42336 2/20 0.53
ELANE P08246 2/20 0.43
AAK1 Q2M2I8 2/20 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
SCHEMBL3477428 0.83 FAAH (0.64) FAAHHDAC6PIK3CAELANEAAK1
SCHEMBL3477307 0.83 FAAH (0.66) FAAHHDAC6PIK3CAELANE
SCHEMBL3475819 0.81 FAAH (0.65) FAAHHDAC6PIK3CAELANEAAK1
SCHEMBL3477409 0.81 FAAH (0.71) FAAHHDAC6PIK3CAELANEAAK1
SCHEMBL13436763 0.81 FAAH (0.76) FAAHHDAC6PIK3CAELANEAAK1
SCHEMBL3475662 0.81 FAAH (0.61) FAAHHDAC6PIK3CAELANE
SCHEMBL3474618 0.80 FAAH (0.62) FAAHHDAC6PIK3CAELANE
SCHEMBL3475416 0.79 FAAH (0.61) FAAHHDAC6PIK3CAELANE
SCHEMBL3475764 0.79 FAAH (1.00) FAAHHDAC6PIK3CA
SCHEMBL3478462 0.79 FAAH (0.59) FAAHHDAC6PIK3CAELANE

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
WO-2010039186-A2 COMPOUNDS USEFUL AS FAAH MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2010-04-08 WO disclosed