SCHEMBL8562172

SCHEMBL8562172

CCCOc1ccc2cccc(OCCC)c2c1OCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.50
CHRM2 P08172 2/20 0.45
TSHR P16473 2/20 0.45
LMNA P02545 2/20 0.45
CHRM1 P11229 1/20 0.45
ALOX15 P16050 1/20 0.45
ACHE P22303 1/20 0.45
KCNH2 Q12809 1/20 0.45
HIF1A Q16665 1/20 0.45
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
HTR1B P28222 3/20 0.40
TLR8 Q9NR97 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.39
HTR1D P28221 1/20 0.39
CYP2A6 P11509 1/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL19612488 0.84 SMN1; SMN2 (0.54) MCHR1LMNAKCNH2CNR2MEN1
SCHEMBL19612345 0.82 SMN1; SMN2 (0.51) MCHR1LMNACNR1CNR2MEN1
SCHEMBL8557526 0.81 LMNA (0.62) MCHR1CHRM2TSHRLMNACHRM1
SCHEMBL19612393 0.79 LTA4H (0.50) MCHR1KCNH2CNR1CNR2HTR1B
SCHEMBL19612222 0.79 MCHR1 (0.49) MCHR1LMNAKCNH2MEN1KMT2A
SCHEMBL7831652 0.79 MCHR1 (0.49) MCHR1CNR1CNR2MEN1KMT2A
SCHEMBL27826948 0.78 CNR1 (0.47) MCHR1TSHRCNR1CNR2MEN1
SCHEMBL15345299 0.78 HTR1B (0.46) MCHR1CNR1CNR2HTR1BTLR8
SCHEMBL19612258 0.78 KCNH2 (0.53) MCHR1KCNH2HTR1BSMN1; SMN2HTR1D
SCHEMBL19612204 0.77 LTA4H (0.49) MCHR1CHRM2TSHRLMNACNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756730-A Process for preparing analgesic compounds SANKYO COMPANY, LIMITED (JP) 1998-05-26 US disclosed
CN-1036004-C Process for preparing analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1997-10-01 CN disclosed
US-5656758-A AMIDATION OF AN AMINE-CONTAINING THIOMORPHOLINE OR PIPERAZINE COMPOUND SANKYO COMPANY, LIMITED (JP) 1997-08-12 US disclosed
CN-1034731-C Process for preparing analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1997-04-30 CN disclosed
US-5512567-A KAPPA-RECEPTOR AGONISTS SANKYO COMPANY, LIMITED (JP) 1996-04-30 US disclosed
CN-1030450-C Preparation of analgesic carboxylic acid amides derivative SANKYO CO (JP) 1995-12-06 CN disclosed
CN-1079741-A The preparation method of analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1993-12-22 CN disclosed
CN-1079740-A The preparation method of analgesic carboxylic acid amide derivatives SANKYO CO (JP) 1993-12-22 CN disclosed
US-5270327-A Piperidine derivatives SANKYO COMPANY, LIMITED (JP) 1993-12-14 US 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
EP-0356247-B1 ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES Sankyo Company Limited (JP) 1993-03-17 EP disclosed
US-5021413-A Analgesic thiomorpholins their preparation, and pharmaceutical compositions containing them SANKYO COMPANY LIMITED (JP) 1991-06-04 US disclosed
CN-1040791-A ANALGESIC CARBOXYLIC ACID AMIDE DERIVATIVES SANKYO CO (JP) 1990-03-28 CN disclosed
EP-0356247-A1 Analgesic carboxylic acid amide derivatives Sankyo Company Limited (JP) 1990-02-28 EP disclosed