SCHEMBL27296352

SCHEMBL27296352

CCOCCCCN1CCC(c2ccccc2)CC1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 1/20 0.65
SIGMAR1 Q99720 5/20 0.62
MEN1 O00255 1/20 0.62
TP53 P04637 1/20 0.62
CYP1A2 P05177 1/20 0.62
CYP3A4 P08684 1/20 0.62
CYP2D6 P10635 1/20 0.62
TSHR P16473 1/20 0.62
CYP2C19 P33261 1/20 0.62
KMT2A Q03164 1/20 0.62
SLC18A3 Q16572 2/20 0.57
CARM1 Q86X55 1/20 0.56
PRMT6 Q96LA8 1/20 0.56
MAOB P27338 1/20 0.54

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
SCHEMBL13612743 0.94 DRD2 (0.69) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL256656 0.84 DRD2 (0.78) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL5888867 0.84 HRH3 (0.68) SIGMAR1MEN1TP53CYP1A2CYP3A4
SCHEMBL27571644 0.83 DRD2 (0.76) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL15779804 0.83 DRD2 (0.76) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL152587 0.83 DRD2 (0.81) DRD2SIGMAR1MEN1TP53CYP1A2
Hydrochloric Acid SCHEMBL7259165 0.81 SIGMAR1 (0.75) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL3399715 0.79 DRD2 (1.00) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL5888791 0.79 HRH3 (0.74) DRD2SIGMAR1MEN1TP53CYP1A2
SCHEMBL2097765 0.78 SIGMAR1 (0.69) DRD2SIGMAR1MEN1TP53CYP1A2

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
CN-1037841-C Process for preparing substituted 4-phenyl-4-piperidinecarboxamide having local anaesthetic and analgesic effect ASTRA CO (SE) 1998-03-25 CN disclosed
CN-1053605-A Preparation method with new replacement 4-phenyl-4-piperidyl urea of toponarcosis and analgesic effect ASTRA AB (SE) 1991-08-07 CN disclosed