SCHEMBL4630218

SCHEMBL4630218

CCCC(=O)C1CNCCN1[C]=O

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.31
GNAO1 P09471 1/20 0.31
GNAI1 P63096 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL3448897 0.87 CHRNB2 (0.33)
SCHEMBL3449345 0.78 CHRNB2 (0.32)
SCHEMBL4629956 0.77 MAPT (0.36)
SCHEMBL8718223 0.77 MAPT (0.36)
SCHEMBL3450210 0.76 NPC1 (0.40) SIGMAR1
SCHEMBL5875452 0.76 LMNA (0.35) GNAI3GNAO1GNAI1SIGMAR1
SCHEMBL8370619 0.74 F2 (0.30)
SCHEMBL3449600 0.73 ALDH1A1 (0.40)
SCHEMBL8710374 0.72 CHRNB2 (0.47) SIGMAR1
SCHEMBL4073459 0.71 CA2 (0.39)

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-1919907-A2 HETEROCYCLIC COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2008-05-14 EP disclosed
WO-2007026959-A2 DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-03-08 WO disclosed