SCHEMBL6674424

SCHEMBL6674424

C=CCOC(=O)N1CCC(COc2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)CC1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 5/20 0.52
▸ GPR119 Q8TDV5 10/20 0.51
▸ F2 P00734 1/20 0.46
▸ PLG P00747 1/20 0.46
▸ SLC2A1 P11166 1/20 0.44
▸ CHEK2 O96017 1/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44

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
SCHEMBL6672245 0.87 F10 (0.57) F10GPR119F2PLGNPC1
SCHEMBL4915392 0.83 GPR119 (0.52) F10GPR119SLC2A1NPC1RAB9A
SCHEMBL6673187 0.82 F10 (0.59) F10GPR119SLC2A1CHEK2NPC1
SCHEMBL6190651 0.80 F10 (0.56) F10SLC2A1
SCHEMBL13097234 0.77 ESR2 (0.56) F10GPR119
SCHEMBL6189777 0.77 F10 (0.66) F10GPR119
SCHEMBL3892320 0.76 ESR2 (0.56) GPR119NPC1RAB9A
SCHEMBL26668458 0.76 SLC2A1 (0.59) GPR119SLC2A1CHEK2
SCHEMBL3242492 0.75 CHEK2 (0.54) GPR119SLC2A1CHEK2
SCHEMBL19833969 0.75 NPC1 (0.47) F10GPR119CHEK2NPC1RAB9A

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-2004035544-A1 BENZO[D]AZEPINE DERIVATIVES FOR THE TREATMENT OF NEUROLOGICAL AND PSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2004-04-29 — — WO disclosed
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