SCHEMBL486048

SCHEMBL486048

CCCCn1cc(C(N)C2CC2)cn1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.33
OPRM1 P35372 3/20 0.32
OPRD1 P41143 3/20 0.32
OPRK1 P41145 3/20 0.32
OPRL1 P41146 3/20 0.32
BTK Q06187 1/20 0.31
CTSD P07339 1/20 0.30
BACE1 P56817 1/20 0.30
BACE2 Q9Y5Z0 1/20 0.30

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
SCHEMBL11914057 0.75 L3MBTL1 (0.40) L3MBTL1BTKCTSDBACE1BACE2
SCHEMBL15000459 0.70 L3MBTL1 (0.39) L3MBTL1
SCHEMBL15650950 0.70 L3MBTL1 (0.44) L3MBTL1BTKCTSDBACE1BACE2
SCHEMBL25123375 0.69 KDR (0.39) L3MBTL1
SCHEMBL15000464 0.69 KDR (0.39) L3MBTL1
SCHEMBL24611400 0.69 KDR (0.39) L3MBTL1
SCHEMBL674823 0.68 L3MBTL1 (0.37) L3MBTL1
SCHEMBL299543 0.68 LMNA (0.43) L3MBTL1CTSDBACE1BACE2
SCHEMBL299542 0.66 L3MBTL1 (0.41) L3MBTL1BTKCTSDBACE1BACE2
SCHEMBL11084604 0.66 L3MBTL1 (0.44) L3MBTL1CTSDBACE1BACE2

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-2411388-A2 PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES Elan Pharmaceuticals Inc. (US) 2012-02-01 EP claimed
EP-2411388-A2 PROCESS FOR THE PRODUCTION OF FUSED, TRICYCLIC SULFONAMIDES Elan Pharmaceuticals Inc. (US) 2012-02-01 EP disclosed