SCHEMBL27264668

SCHEMBL27264668

CCCC(=N)CC1CSCCN1C(=O)C1CCc2cc(C(C)C)ccc21

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.32
MTNR1B P49286 1/20 0.30
ESR1 P03372 1/20 0.30
ESR2 Q92731 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
SCHEMBL27264664 0.93 CYP2D6 (0.37) CYP2D6MTNR1B
SCHEMBL27264360 0.87 DRD2 (0.33)
SCHEMBL27264161 0.85 CRBN (0.38) MTNR1B
SCHEMBL27264292 0.84
SCHEMBL27264707 0.83 KDM4E (0.32)
SCHEMBL27263576 0.82 DRD2 (0.38) MTNR1B
SCHEMBL8558391 0.81 CYP2D6 (0.34) CYP2D6
SCHEMBL27264454 0.81 OPRK1 (0.32)
SCHEMBL8558229 0.81 CYP2D6 (0.35) CYP2D6
SCHEMBL8562819 0.77 HRH3 (0.34) CYP2D6

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