SCHEMBL6279906

SCHEMBL6279906

C=Cc1ccccc1OC(CC)CCC

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.35
PPARG P37231 2/20 0.34
PPARA Q07869 2/20 0.34
ADRA2B P18089 7/20 0.34
ADRA2C P18825 7/20 0.34
ADRA2A P08913 6/20 0.34
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 2/20 0.32
LMNA P02545 1/20 0.32
HTR1A P08908 2/20 0.32
KCNH2 Q12809 1/20 0.32
AOC3 Q16853 1/20 0.30
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8522042 0.83 ALDH1A1 (0.34) ADRA2BADRA2CADRA2AALDH1A1MEN1
SCHEMBL6468627 0.81 MAPT (0.35) ALDH1A1MEN1CYP3A4KMT2AHPGD
SCHEMBL27744784 0.80 NR2E1 (0.37) MCHR1ADRA2BADRA2CADRA2AMEN1
SCHEMBL29266697 0.78 ALDH1A1 (0.32) ADRA2BADRA2CADRA2AALDH1A1MEN1
SCHEMBL27528404 0.78 MCHR1 (0.42) MCHR1ADRA2BADRA2CADRA2AALDH1A1
SCHEMBL5373674 0.77 ADRA2A (0.34) ADRA2BADRA2CADRA2AALDH1A1MEN1
SCHEMBL7541880 0.77 SIGMAR1 (0.33) PPARGADRA2BADRA2CADRA2AALDH1A1
SCHEMBL27744776 0.76 ADRA2B (0.33) ADRA2BADRA2CADRA2AALDH1A1MEN1
SCHEMBL6287591 0.76 MCHR1 (0.37) MCHR1ADRA2BADRA2CADRA2AALDH1A1
SCHEMBL14017865 0.76 CYP1A2 (0.44) MCHR1PPARGPPARAADRA2BALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6900273-B1 Low-hygroscopicity low-birefringence resin compositions, molding material obtained therefrom, sheet or film, and optical part HITACHI CHEMICAL CO., LTD. (JP) 2005-05-31 US disclosed
US-20040220342-A1 Low-hygroscopicity low-birefringence resin compositions, molding material, sheet or film obtained therefrom, and optical part YAMASHITA YUKIHIKO (JP) 2004-11-04 US disclosed
EP-1205517-A1 LOW-HYGROSCOPICITY LOW-BIREFRINGENCE RESIN COMPOSITIONS, MOLDING MATERIAL OBTAINED THEREFROM, SHEET OR FILM, AND OPTICAL PART HITACHI CHEMICAL COMPANY, LTD. (JP) 2002-05-15 EP disclosed