SCHEMBL11086175

SCHEMBL11086175

CCc1noc(C)c1-c1[nH]c2ccc(F)cc2c1C(=O)CCN(C)C

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TLR9 Q9NR96 2/20 0.35
TLR8 Q9NR97 2/20 0.35
TLR7 Q9NYK1 2/20 0.35
PADI4 Q9UM07 1/20 0.35
BRD4 O60885 1/20 0.35

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
SCHEMBL11080541 0.89 BRD4 (0.42) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL10832655 0.87 KMT2A (0.40) NPC1RAB9A
SCHEMBL11079151 0.86 NPC1 (0.40) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL10977643 0.85 NPC1 (0.38) NPC1RAB9A
SCHEMBL10831709 0.84 MAPT (0.43) PADI4BRD4
SCHEMBL10984221 0.83 NPC1 (0.39) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL11089655 0.80 TLR9 (0.37) TLR9TLR8TLR7BRD4
SCHEMBL10977892 0.79 POLB (0.43) NPC1RAB9A
SCHEMBL10831731 0.78 TLR8 (0.34) GABRA1GABRG2GABRB3GABRA5GABRA3
SCHEMBL10832301 0.77 EGFR (0.39) GABRA1GABRG2GABRB3GABRA5GABRA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4467096-A ANTIDIABETIC AGENTS, INTERMEDIATES THEREFOR SANDOZ, INC. (US) 1984-08-21 US disclosed
US-4421752-A ANTIDIABETIC AGENT SANDOZ, INC. (US) 1983-12-20 US disclosed
US-4336391-A ANTIDIABETIC AGENTS SANDOZ, INC. (US) 1982-06-22 US disclosed