SCHEMBL4126596

SCHEMBL4126596

CC1CC(c2ccc(O)c(Br)c2)CC(C)(C)C1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
CYP2C19 P33261 2/20 0.37
LMNA P02545 2/20 0.37
CYP3A4 P08684 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
ESR1 P03372 2/20 0.36
ESR2 Q92731 2/20 0.36
HTT P42858 1/20 0.36
ALOX15 P16050 3/20 0.34
KDM4E B2RXH2 3/20 0.33
KDM1A O60341 2/20 0.33
CASP1 P29466 2/20 0.33
CASP7 P55210 2/20 0.33
HSD17B10 Q99714 2/20 0.33
KDM1B Q8NB78 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2B6 P20813 1/20 0.33
QDPR P09417 2/20 0.33
USP2 O75604 1/20 0.32

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
SCHEMBL4317921 1.00 ALDH1A1 (0.37) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL7119393 0.84 ESR1 (0.43) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL6589192 0.83 ALDH1A1 (0.35) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL6589188 0.83 ALDH1A1 (0.35) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL19031705 0.82 LMNA (0.37) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL28361734 0.82 ESR1 (0.40) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL5452463 0.80 ACMSD (0.56) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL19031721 0.80 LMNA (0.36) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL7067810 0.80 ALDH1A1 (0.39) ALDH1A1CYP2C19LMNACYP3A4CYP1A2
SCHEMBL6590732 0.80 ALDH1A1 (0.40) ALDH1A1CYP2C19LMNACYP3A4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113166500-A Polyethylene with additives for increasing environmental stress crack resistance SABIC环球技术有限责任公司 2021-07-23 CN disclosed
CN-108463481-B Method for producing polycarbonate 国际壳牌研究有限公司 2021-04-09 CN disclosed
CN-112313277-A Polyethylene with polycarbonate-siloxane for improved environmental stress crack resistance SABIC环球技术有限责任公司 2021-02-02 CN disclosed
CN-108473672-B Process for preparing melt polycarbonate 国际壳牌研究有限公司 2020-12-08 CN disclosed
CN-101796109-B Polymer foam having nanocellular morphology and method of making same SABIC INNOVATIVE PLASTICS IP 2012-12-26 CN disclosed
CN-102775752-A Polymeric foams with nanocellular morphology and methods for making them SABIC INNOVATIVE PLASTICS IP 2012-11-14 CN disclosed
CN-102516518-A Method of preparing polycarbonate SABIC INNOVATIVE PLASTICS IP 2012-06-27 CN disclosed
CN-101056913-B Process to make polycarbonate from bismethylsalicylcarbonate (BMSC) SABIC INNOVATIVE PLASTICS IP 2011-09-14 CN disclosed
CN-101479315-B Preparation of polycarbonates SABIC INNOVATIVE PLASTICS IP 2011-09-14 CN disclosed
CN-101331169-B Equipment cleaning in polycarbonate manufacture GEN ELECTRIC 2011-09-07 CN disclosed
EP-2052009-A1 METHOD OF PREPARING POLYCARBONATE GENERAL ELECTRIC COMPANY (US) 2009-04-29 EP disclosed
CN-101400763-A Halogen-free polycarbonate compositions and articles formed therefrom SABIC INNOVATIVE PLASTICS IP (NL) 2009-04-01 CN disclosed
CN-101346411-A Polycarbonates containing low levels of methyl salicylate prepared by a melt polymerization in a reactive extruder GEN ELECTRIC (US) 2009-01-14 CN disclosed
CN-101336231-A Methods for increasing the mean particle size of 2-hydrocarbyl-3,3-bis(hydroxyaryl)phthalimidines GEN ELECTRIC (US) 2008-12-31 CN disclosed
CN-101331169-A Equipment cleaning in polycarbonate manufacture GEN ELECTRIC (US) 2008-12-24 CN disclosed
WO-2008005648-A1 METHOD OF PREPARING POLYCARBONATE GENERAL ELECTRIC COMPANY (US) 2008-01-10 WO disclosed
CN-101056913-A Process to make polycarbonate from bismethylsalicylcarbonate (BMSC) GEN ELECTRIC (US) 2007-10-17 CN disclosed
CN-1972982-A Method for preparing a polycarbonate oligomer mixture at low temperature for manufacturing polycarbonate GEN ELECTRIC (US) 2007-05-30 CN disclosed
CN-1914248-A Process for the production of copolycarbonates with reduced color GEN ELECTRIC (US) 2007-02-14 CN disclosed
CN-1694914-A Method and apparatus for preparing high molecular weight melt polycarbonate GEN ELECTRIC (US) 2005-11-09 CN disclosed