SCHEMBL6429540

SCHEMBL6429540

NC(=O)N1CCCCC1Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.58
DPP4 P27487 1/20 0.56
DAGLA Q9Y4D2 12/20 0.55
ABHD6 Q9BV23 8/20 0.55
PARP14 Q460N5 1/20 0.54
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
SCD5 Q86SK9 1/20 0.51
DAGLB Q8NCG7 2/20 0.51
GABRA1 P14867 1/20 0.50
GABRG2 P18507 1/20 0.50
GABRB3 P28472 1/20 0.50
GABRA3 P34903 1/20 0.50
GABRA2 P47869 1/20 0.50
GABRB2 P47870 1/20 0.50

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
SCHEMBL5800629 0.89 TACR1 (0.46) HSD11B1DPP4DAGLAABHD6SCD5
SCHEMBL4964339 0.88 HSD11B1 (0.61) HSD11B1DPP4DAGLAABHD6MEN1
SCHEMBL4629395 0.88 HSD11B1 (0.61) HSD11B1DPP4DAGLAABHD6MEN1
Hydrochloric Acid SCHEMBL29238125 0.86 HSD11B1 (0.60) HSD11B1DPP4DAGLAABHD6MEN1
SCHEMBL6970610 0.85 MEN1 (0.54) MEN1NPC1RAB9AKMT2A
SCHEMBL27651068 0.85 HSD11B1 (0.58) HSD11B1DPP4DAGLAABHD6MEN1
SCHEMBL21138521 0.85 HSD11B1 (0.62) HSD11B1DPP4DAGLAABHD6MEN1
SCHEMBL11481440 0.84 HSD11B1 (0.57) HSD11B1DPP4DAGLAABHD6MEN1
SCHEMBL23459127 0.83 SCD5 (0.57) HSD11B1DPP4DAGLAABHD6MEN1
SCHEMBL908981 0.83 SCD5 (0.57) HSD11B1DPP4DAGLAABHD6MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2668157-A1 PROTEASE ACTIVATED RECEPTOR 2 (PAR2) ANTAGONISTS Proximagen Limited (GB) 2013-12-04 EP disclosed
WO-2012101453-A1 PROTEASE ACTIVATED RECEPTOR 2 (PAR2) ANTAGONISTS PROXIMAGEN LTD. (GB) 2012-08-02 WO disclosed
EP-1585749-A1 DIAZEPINOINDOLE DERIVATIVES AS KINASE INHIBITORS PFIZER INC. (US) 2005-10-19 EP disclosed
WO-2004063198-A1 DIAZEPINOINDOLE DERIVATIVES AS KINASE INHIBITORS PFIZER INC. (US) 2004-07-29 WO disclosed
EP-0351283-A1 2-[(4-Piperidinyl)methyl]-2,3-dihydro-1H-isoindole and 2,3,4,5-tetrahydro-1H-benzazepine derivatives, their preparation and therapeutical use SYNTHELABO (FR) 1990-01-17 EP disclosed