SCHEMBL2774237

SCHEMBL2774237

CC(c1[c]c(C(C)(C)C)cc(C(C)(C)C)c1)c1cc(C(C)(C)C)cc(C(C)(C)C)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 3/20 0.45
CYP2C19 P33261 3/20 0.45
CYP3A4 P08684 2/20 0.45
CYP1A2 P05177 2/20 0.45
TSHR P16473 1/20 0.45
HSP90AA1 P07900 1/20 0.35
CA2 P00918 3/20 0.33
CA1 P00915 2/20 0.33
HPN P05981 1/20 0.33
MAPT P10636 1/20 0.33
ALOX15 P16050 1/20 0.33
SIRT5 Q9NXA8 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33
TYR P14679 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NR5A2 O00482 1/20 0.32
NR5A1 Q13285 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31

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
SCHEMBL994712 0.88 CYP1A2 (0.40) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL27322 0.81 CYP1A2 (0.57) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL30962428 0.81 CYP1A2 (0.57) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL4285008 0.80 CA2 (0.47) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL4447787 0.79 GABRA1 (0.33) POLBGABRA1GABRB2
SCHEMBL2704990 0.76 CYP1A2 (0.33) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL12626210 0.75 CYP2C9 (0.51) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL14599163 0.75 CYP3A4 (0.51) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL2718090 0.75 GAA (0.40) CYP2C9CYP2C19CYP3A4CYP1A2TSHR
SCHEMBL6768184 0.74 CYP1A2 (0.57) CYP2C9CYP2C19CYP3A4CYP1A2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697393-B1 Purification of bisphenol monoester SUMITOMO CHEMICAL CO (JP) 1999-08-25 EP claimed
CN-115353728-B Composite material of modified PC and TPU, and preparation method and application thereof 四川龙华光电薄膜股份有限公司 2023-06-23 CN disclosed
CN-115304903-B TPU modified resin and application 四川龙华光电薄膜股份有限公司 2023-06-23 CN disclosed
CN-115353728-A Modified PC and TPU composite material and preparation method and application thereof 四川龙华光电薄膜股份有限公司 2022-11-18 CN disclosed
CN-115304903-A TPU modified resin and application 四川龙华光电薄膜股份有限公司 2022-11-08 CN disclosed
CN-103289210-A Polypropylene resin composition and molded body containing same SUMITOMO CHEMICAL CO 2013-09-11 CN disclosed
US-20130109789-A1 OLEFIN POLYMERIZATION CATALYST, PROCESS FOR PRODUCING OLEFIN POLYMER, POLYPROPYLENE RESIN COMPOSITION AND ARTICLE COMPRISING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-02 US disclosed
EP-2559737-A1 THERMOPLASTIC POLYMER COMPOSITION AND STABILISER COMPOSITION Sumitomo Chemical Co., Ltd (JP) 2013-02-20 EP disclosed
EP-2559734-A1 THERMOPLASTIC POLYMER COMPOSITION AND PROCESSING STABILISER Sumitomo Chemical Co., Ltd (JP) 2013-02-20 EP disclosed
EP-2559736-A1 THERMOPLASTIC POLYMER COMPOSITION AND STABILISER COMPOSITION Sumitomo Chemical Company Limited (JP) 2013-02-20 EP disclosed
EP-2559735-A1 THERMOPLASTIC POLYMER COMPOSITION AND PROCESSING STABILISER Sumitomo Chemical Company Limited (JP) 2013-02-20 EP disclosed
EP-2154199-B1 FLAME-RETARDANT POLYCARBONATE RESIN COMPOSITION TEIJIN LTD (JP) 2013-02-13 EP disclosed
US-20130035426-A1 THERMOPLASTIC POLYMER COMPOSITION AND STABILISER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-07 US disclosed
US-20100041806-A1 PHENOL COMPOSITION AND THERMOPLASTIC POLYMER COMPOSITION COMPRISING THE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-02-18 US disclosed
EP-2154199-A1 FLAME-RETARDANT POLYCARBONATE RESIN COMPOSITION Teijin Limited (JP) 2010-02-17 EP disclosed
EP-2154189-A1 Phenol composition and thermoplastic polymer composition comprising the composition Sumitomo Chemical Company, Limited (JP) 2010-02-17 EP disclosed