SCHEMBL12802408

SCHEMBL12802408

C=CC(=C)Cc1cccc(CCCC)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRB P10828 6/20 0.44
THRA P10827 5/20 0.44
LPL P06858 2/20 0.44
LIPG Q9Y5X9 2/20 0.44
XIAP P98170 1/20 0.42
NPC1 O15118 1/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PPARG P37231 1/20 0.38
PPARA Q07869 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
SCHEMBL12802157 0.90 THRB (0.41) THRBLPLLIPG
SCHEMBL12802178 0.87 THRA (0.44) THRBTHRALPLLIPGXIAP
SCHEMBL12802217 0.87 THRA (0.44) THRBTHRALPLLIPGXIAP
SCHEMBL31707502 0.84 GRIN2D (0.36) MEN1KMT2A
SCHEMBL12802874 0.83 THRB (0.57) THRBTHRAHPGDMEN1KMT2A
SCHEMBL12802166 0.83 TP53 (0.37) HPGDMAPK1HTTKMT2A
SCHEMBL12802391 0.81 LPL (0.41) THRBTHRALPLLIPGXIAP
SCHEMBL347126 0.78 LPL (0.57) LPLLIPGXIAPNPC1HPGD
SCHEMBL3030289 0.78 LPL (0.50) LPLLIPGXIAPNPC1HPGD
SCHEMBL31707439 0.78 NOS1 (0.40) LPLLIPGNPC1MAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9587042-B2 Process for producing modified conjugated diene-based polymer, modified conjugated diene-based polymer, and polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-03-07 US disclosed
US-8933165-B2 Method for producing modified conjugated diene-based polymer, and method for producing polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-01-13 US disclosed
US-8835564-B2 Method for producing modified conjugated diene-based polymer, and method for producing polymer composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-09-16 US disclosed
US-20140088242-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION ZEON CORPORATION (JP) 2014-03-27 US disclosed
US-20140088256-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION ZEON CORPORATION (JP) 2014-03-27 US disclosed
US-20120252966-A1 PROCESS FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, MODIFIED CONJUGATED DIENE-BASED POLYMER, AND POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED 2012-10-04 US disclosed