SCHEMBL8077541

SCHEMBL8077541

C=CCCc1ccc(CCC)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
THRB P10828 7/20 0.52
LPL P06858 2/20 0.45
LIPG Q9Y5X9 2/20 0.45
TSHR P16473 2/20 0.43
CA2 P00918 1/20 0.42
THRA P10827 5/20 0.40
ALDH1A1 P00352 2/20 0.40
MGLL Q99685 1/20 0.39
PLK1 P53350 1/20 0.39
CNR1 P21554 1/20 0.39
CNR2 P34972 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL20058177 0.94 THRB (0.47) THRBLPLLIPGTSHRCA2
SCHEMBL7860167 0.88 ACACB (0.44) THRBLPLLIPGCA2
SCHEMBL9004469 0.87 GFER (0.36) THRBTSHRCA2THRAALDH1A1
SCHEMBL4636535 0.86 THRB (0.55) THRBTSHRCA2THRAALDH1A1
SCHEMBL8077551 0.86 THRB (0.48) THRBLPLLIPGTSHRTHRA
SCHEMBL1149698 0.86 TAAR1 (0.50) THRBLPLLIPGTSHRCA2
SCHEMBL12802272 0.86 TSHR (0.43) THRBLPLLIPGTSHRALDH1A1
SCHEMBL8148750 0.85 GRIN2D (0.45) THRBLPLLIPGTSHRCA2
SCHEMBL8148747 0.85 GRIN2D (0.45) THRBLPLLIPGTSHRCA2
SCHEMBL6285109 0.85 GFER (0.41) THRBTSHRTHRAALDH1A1CNR1

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 9 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
US-6063940-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-05-16 US disclosed
US-5637736-A Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-10 US disclosed
EP-0637580-A1 Process for preparing 1-bromoalkylbenzene derivatives and intermediates thereof SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1995-02-08 EP disclosed