SCHEMBL6976079

SCHEMBL6976079

CN(CC=Cc1ccccc1)CCO

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
NR1I2 O75469 1/20 0.51
DRD2 P14416 1/20 0.51
ADRA2C P18825 1/20 0.51
CNR1 P21554 1/20 0.51
SLC6A2 P23975 1/20 0.51
HTR2A P28223 1/20 0.51
SLC6A4 P31645 1/20 0.51
ADRA1A P35348 1/20 0.51
OPRK1 P41145 1/20 0.51
SLC6A3 Q01959 1/20 0.51
KCNH2 Q12809 1/20 0.51
EBP Q15125 1/20 0.51
SIGMAR1 Q99720 1/20 0.51
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
TSHR P16473 1/20 0.51
CYP2C19 P33261 1/20 0.51

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
SCHEMBL6976076 1.00 MEN1 (0.51) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL12507449 0.90 MEN1 (0.49) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL12507453 0.88 MEN1 (0.48) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL5426277 0.85 HTR2A (0.60) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL5426275 0.85 HTR2A (0.60) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL6974136 0.82 KDM4E (0.51) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL6974141 0.82 KDM4E (0.51) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL14496791 0.82 HTR2A (0.51) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL12507269 0.81 KCNH2 (0.50) MEN1KMT2ANR1I2DRD2ADRA2C
SCHEMBL8973646 0.81 KCNH2 (0.50) MEN1KMT2ANR1I2DRD2ADRA2C

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-0801063-B1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic, antihypertensive properties, process for their preparation and pharmaceutical compositions containing them REDDYS LAB LTD DR (IN) 2003-01-15 EP disclosed
EP-0801063-A1 Thiazolidinedione derivatives having antidiabetic, hypolipidaemic antihypertensive properties, process for their preparation and pharmaceutical compositions containing them DR. REDDY'S RESEARCH FOUNDATION (IN) 1997-10-15 EP disclosed
US-5137889-A Hypotensive agents; coronary vasodilators; calcium antagonists; antiinflammatory agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-08-11 US disclosed
US-5034395-A Hypotensive agents, carboxylated dihydropyridines OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-07-23 US disclosed
EP-0145434-A2 Novel dihydropyridine derivatives and process for preparing the same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1985-06-19 EP disclosed