SCHEMBL7447366

SCHEMBL7447366

C#CCN(C(C)C)C1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ADH1C P00326 2/20 0.38
ADH1A P07327 2/20 0.38
ADH1B P00325 1/20 0.38
ACHE P22303 3/20 0.33
CCKBR P32239 1/20 0.32

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
SCHEMBL10778125 0.90 SLC6A2 (0.31)
SCHEMBL4371656 0.80 ADH1C (0.38) ADH1CADH1AADH1B
SCHEMBL4382387 0.78 DPP4 (0.39) ADH1CADH1AADH1B
SCHEMBL13301673 0.76 ADH1A (0.45) ADH1CADH1AADH1B
SCHEMBL27861354 0.75 ACHE (0.30) ACHE
SCHEMBL13503176 0.74 ADH1A (0.43) ADH1CADH1AADH1B
SCHEMBL4570869 0.74 ADH1A (0.43) ADH1CADH1AADH1B
SCHEMBL736379 0.72 ADH1A (0.42) ADH1CADH1AADH1B
SCHEMBL4973138 0.72 HRH4 (0.41) ADH1CADH1A
SCHEMBL10433622 0.72 ADH1A (0.42) ADH1CADH1AADH1B

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-6482986-B1 Benzene derivatives, preparation method and pharmaceutical compositions containing same SANOFI-SYNTHELABO (FR) 2002-11-19 US disclosed
EP-1192122-A1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2002-04-03 EP disclosed
WO-2000076953-A1 BENZENE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME SANOFI-SYNTHELABO (FR) 2000-12-21 WO disclosed