SCHEMBL12802473

SCHEMBL12802473

C=CC(=C)CCCc1ccc(CCC)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 10/20 0.51
THRA P10827 7/20 0.49
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
LPL P06858 3/20 0.41
LIPG Q9Y5X9 3/20 0.41
ESR1 P03372 2/20 0.40
ADRA2A P08913 2/20 0.40
ADORA3 P0DMS8 2/20 0.40
TACR2 P21452 2/20 0.40
SLC6A2 P23975 2/20 0.40
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HSD17B10 Q99714 2/20 0.40
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
SHBG P04278 1/20 0.40
TP53 P04637 1/20 0.40
CYP3A4 P08684 1/20 0.40

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
SCHEMBL12802474 0.93 THRB (0.57) THRBTHRAMEN1KMT2AESR1
SCHEMBL12802089 0.89 THRB (0.45) THRBTHRAMEN1KMT2ALPL
SCHEMBL12802152 0.89 THRB (0.55) THRBTHRAMEN1KMT2ALPL
SCHEMBL12802391 0.86 LPL (0.41) THRBTHRALPLLIPG
SCHEMBL12802085 0.85 THRB (0.57) THRBTHRAMEN1KMT2AESR1
SCHEMBL12802074 0.85 IGF1R (0.44) THRBTHRAMEN1KMT2AALDH1A1
SCHEMBL31707487 0.84 THRB (0.44) THRBTHRAMEN1KMT2AESR1
SCHEMBL12802039 0.81 THRB (0.55) THRBTHRAMEN1KMT2ALPL
SCHEMBL12802178 0.80 THRA (0.44) THRBTHRAMEN1KMT2ALPL
SCHEMBL12802332 0.79 THRB (0.42) THRBTHRALIPGALDH1A1CYP3A4

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