SCHEMBL2553722

SCHEMBL2553722

C=CCc1ccc(CCC)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
CYP3A4 P08684 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
TP53 P04637 1/20 0.54
ALOX15 P16050 1/20 0.54
TSHR P16473 1/20 0.54
ALOX12 P18054 1/20 0.54
THRB P10828 4/20 0.52
LPL P06858 2/20 0.45
LIPG Q9Y5X9 2/20 0.45
PPARG P37231 2/20 0.44
PPARD Q03181 2/20 0.44
PPARA Q07869 1/20 0.44
XDH P47989 1/20 0.43
CNR1 P21554 2/20 0.42
CNR2 P34972 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH2 P05091 1/20 0.42
GAA P10253 1/20 0.42

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
SCHEMBL6513657 0.94 ALDH1A1 (0.48) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL9617250 0.88 ACACB (0.44) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL7188791 0.86 THRB (0.55) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL7789212 0.85 GRIN2D (0.45) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL7789215 0.85 GRIN2D (0.45) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL6284374 0.85 ALDH1A1 (0.56) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL9311279 0.85 THRB (0.56) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15
SCHEMBL5613810 0.83 THRB (0.57) ALDH1A1CYP3A4TP53THRBLPL
SCHEMBL6801310 0.83 THRB (0.57) ALDH1A1CYP3A4TP53THRBLPL
SCHEMBL173301 0.82 ALDH1A1 (0.64) ALDH1A1CYP3A4SMN1; SMN2TP53ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117125710-A Monodisperse nitrogen doped polymer-based nano activated carbon sphere with controllable particle size and preparation method thereof 北京化工大学 2023-11-28 CN claimed
CN-113443625-A Preparation method of polystyrene resin-based spherical activated carbon 华东理工大学 2021-09-28 CN claimed
CN-106065003-A Sorbitol derivatives and its synthetic dbs kinds of polyolefin nucleating agent and its preparation method and application thereof 苏州亚培克生物科技有限公司 2016-11-02 CN claimed
CN-117125710-A Monodisperse nitrogen doped polymer-based nano activated carbon sphere with controllable particle size and preparation method thereof 北京化工大学 2023-11-28 CN disclosed
CN-113443625-A Preparation method of polystyrene resin-based spherical activated carbon 华东理工大学 2021-09-28 CN disclosed
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-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-20140088242-A1 METHOD FOR PRODUCING MODIFIED CONJUGATED DIENE-BASED POLYMER, AND METHOD FOR PRODUCING POLYMER COMPOSITION ZEON CORPORATION (JP) 2014-03-27 US disclosed
EP-2555623-A1 FLAVIN DERIVATIVES BioRelix, Inc. (US) 2013-02-13 EP 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
WO-2011126567-A1 FLAVIN DERIVATIVES BIORELIX, INC. (US) 2011-10-13 WO disclosed
US-6534595-B2 Blend of thermosetting resin, decomposable resin and solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-18 US disclosed
US-20010038887-A1 Coating solution for forming porous organic film SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-11-08 US disclosed
CN-1280995-A Trapezoidal polysiloxane containing organic bridge radical and its preparing process CHINESE ACAD INST CHEMISTRY (CN) 2001-01-24 CN 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
US-4062862-A MUSCLE RELAXANT NIPPON CHEMIPHAR CO., LTD. (JA) 1977-12-13 US disclosed