SCHEMBL27264161

SCHEMBL27264161

CCCC(=N)CC1CSCCN1C(=O)C1CCc2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 8/20 0.38
PREP P48147 4/20 0.36
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
PIN1 Q13526 2/20 0.35
DDB1 Q16531 1/20 0.35
KCNQ2 O43526 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.33

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
SCHEMBL27263576 0.87 DRD2 (0.38) MTNR1B
SCHEMBL27264360 0.87 DRD2 (0.33)
SCHEMBL27264292 0.85
SCHEMBL27264664 0.85 CYP2D6 (0.37) MTNR1B
SCHEMBL27264668 0.85 CYP2D6 (0.32) MTNR1B
SCHEMBL27294965 0.85 KCNQ2 (0.40) CRBNPREPMTNR1AMTNR1BPIN1
Hydrochloric Acid SCHEMBL27294971 0.84 KCNQ2 (0.40) CRBNPREPMTNR1AMTNR1BPIN1
SCHEMBL27264042 0.83 CRBN (0.39) CRBNMTNR1AMTNR1BPIN1KCNQ2
SCHEMBL27264883 0.81 MEN1 (0.36) PREPPTGDR2
SCHEMBL8559582 0.78 HRH3 (0.44) CRBNPREPPIN1DDB1KCNQ2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1030450-C Preparation of analgesic carboxylic acid amides derivative SANKYO CO (JP) 1995-12-06 CN disclosed
CN-1079740-A The preparation method of analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1993-12-22 CN disclosed
CN-1079741-A The preparation method of analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1993-12-22 CN disclosed
CN-1078461-A The preparation method of analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1993-11-17 CN disclosed
CN-1022185-C Process for preparing analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1993-09-22 CN disclosed
CN-1040791-A ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES SANKYO CO (JP) 1990-03-28 CN disclosed