SCHEMBL5346301

SCHEMBL5346301

CC(C)(C)c1cc(OC(=O)CCCCC(=O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 11/20 0.68
CA1 P00915 2/20 0.46
CA2 P00918 2/20 0.46
GPR55 Q9Y2T6 1/20 0.43
GLRA3 O75311 1/20 0.41
GLRB P48167 1/20 0.41
TSHR P16473 1/20 0.41
ALOX5 P09917 1/20 0.40
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40
GAA P10253 1/20 0.39
LMNA P02545 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL38445 0.94 VCAM1 (0.60) VCAM1CA1CA2ALOX5PTGS1
SCHEMBL1577556 0.92 VCAM1 (0.61) VCAM1CA1CA2ALOX5PTGS1
SCHEMBL5027033 0.88 VCAM1 (0.55) VCAM1CA1CA2ALOX5PTGS1
SCHEMBL27769174 0.87 VCAM1 (0.56) VCAM1CA1CA2GAA
SCHEMBL7155322 0.87 VCAM1 (0.56) VCAM1CA1CA2GAA
SCHEMBL27747905 0.87 VCAM1 (0.56) VCAM1CA1CA2GAA
SCHEMBL27769201 0.87 VCAM1 (0.56) VCAM1CA1CA2GAA
SCHEMBL11347714 0.87 VCAM1 (0.56) VCAM1CA1CA2GAA
SCHEMBL39477 0.87 VCAM1 (0.56) VCAM1CA1CA2GAA
SCHEMBL28853602 0.86 VCAM1 (0.54) VCAM1CA1CA2ALOX5PTGS1

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 118 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1810880-A Composition and process for improving heat and weathering stability of segmented polyurethane polymers CIBA SC HOLDING AG (CH) 2006-08-02 CN claimed
EP-3658616-A1 HALOGEN-FREE SULPHONIC ACID ESTER AND/OR SULPHINIC ACID ESTER AS FLAME RETARDANT, FLAME RETARDANT SYNERGISTS AND RADICAL GENERATORS IN PLASTICS Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2020-06-03 EP disclosed
CN-108699351-A The coated pigment based on BiOX 费罗公司 2018-10-23 CN disclosed
CN-103969863-B Liquid crystal display device 三星显示有限公司 2018-09-25 CN disclosed
CN-105754099-B Composition and polymer 旭化成株式会社 2018-09-18 CN disclosed
CN-107849456-A Polymerisable liquid crystal material and aggregated liquid crystal film 默克专利股份有限公司 2018-03-27 CN disclosed
CN-107690468-A reactive mesogen 默克专利股份有限公司 2018-02-13 CN disclosed
CN-107384440-A Polymerisable liquid crystal material and aggregated liquid crystal film 默克专利股份有限公司 2017-11-24 CN disclosed
CN-105308130-B Coated carbon fiber reinforced plastic part 巴斯夫欧洲公司 2017-09-29 CN disclosed
CN-107207544-A Phosphorous acid compound, process for producing the same, and use thereof 住友化学株式会社 2017-09-26 CN disclosed
CN-1171422-A Hydroxyphenyltriazines CIBA GEIGY AG (CH) 1998-01-28 CN disclosed
CN-1140730-A Halogen-containing polymers provided with antistatic agent CIBA GEIGY AG (CH) 1997-01-22 CN disclosed
CN-1029623-C Stabilized polyacetal compositions DU PONT (US) 1995-08-30 CN disclosed
CN-1029622-C Stabilized polyacetal compositions DU PONT (US) 1995-08-30 CN disclosed
CN-1106032-A Benzofuran-2-ones as stabilisers CIBA GEIGY AG (CH) 1995-08-02 CN disclosed
CN-1083081-A stable polyacetal composition DU PONT (US) 1994-03-02 CN disclosed
CN-1083080-A stable polyacetal composition DU PONT (US) 1994-03-02 CN disclosed
CN-1022842-C Stabilized polyacetal compositions E I DU PONT OF NEMOURS AND CO (US) 1993-11-24 CN disclosed
CN-1073460-A Stabilizer blend CIBA GEIGY AG (CH) 1993-06-23 CN disclosed
CN-1053436-A STABILIZED POLYACETAL COMPOSITIONS DU PONT (US) 1991-07-31 CN disclosed