SCHEMBL8675930

SCHEMBL8675930

CCCCCCCCCCC(CCCC(Cc1ccc(O)cc1)C(C)(C)C)C(C)(C)C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 5/20 0.53
SLC6A2 P23975 3/20 0.53
PTGS2 P35354 3/20 0.53
ADRA2A P08913 2/20 0.53
ADORA3 P0DMS8 2/20 0.53
TACR2 P21452 2/20 0.53
SLC6A4 P31645 2/20 0.53
SLC6A3 Q01959 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ALDH1A1 P00352 1/20 0.53
LMNA P02545 1/20 0.53
SHBG P04278 1/20 0.53
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
HSPD1 P10809 1/20 0.53
ADRB3 P13945 1/20 0.53
HTR2C P28335 1/20 0.53
HSPE1 P61604 1/20 0.53
HIF1A Q16665 1/20 0.53
TST Q16762 1/20 0.53

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
SCHEMBL8674114 1.00 ESR1 (0.53) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL105327 1.00 ESR1 (0.53) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL688630 0.97 ESR1 (0.56) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL107938 0.97 ESR1 (0.56) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL106676 0.97 ESR1 (0.56) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL1240638 0.97 ESR1 (0.56) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL872141 0.95 ESR1 (0.53) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL27715462 0.94 ESR1 (0.47) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL8677681 0.92 ESR1 (0.47) ESR1SLC6A2PTGS2ADRA2AADORA3
SCHEMBL6897660 0.91 ESR1 (0.50) ESR1SLC6A2PTGS2ADRA2AADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1146637-C Polymer composition and core-shell elastomer used therefor 三井化学株式会社 2004-04-21 CN disclosed
CN-1052022-C Polymer composition and core-shell elastomer for use in the composition MITSUI PETROCHEMICAL IND (JP) 2000-05-03 CN disclosed
CN-1215069-A Polymer composition and core-shell elastomer used therefor MITSUI CHEMICALS INC (JP) 1999-04-28 CN disclosed
US-5770655-A ACRYLATE MONOMER WITH MULTICYCLIC FUSED RING IN ESTER GROUP, OPTICAL FIBERS AND DISKS, CLARITY AND IMPACT STRENGTH, TETRACYCLODODECYL ACRYLATE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1998-06-23 US disclosed
US-5574100-A ALPHA-OLEFIN-CYCLIC OLEFIN COPOLYMER, BUTADIENE-STYRENE COPOLYMER CORE, ALICYCLIC ACRYLATE SHELL MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1996-11-12 US disclosed
CN-1111658-A Polymer composition and core-shell elastomer for use in the composition MITSUI PETROCHEMICAL IND (JP) 1995-11-15 CN disclosed
EP-0671433-A1 Polymer composition and core-shell elastomer used therefor MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1995-09-13 EP disclosed