SCHEMBL930119

SCHEMBL930119

CC(C)(C)CC(C)(C)c1c[c]ccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHBG P04278 1/20 0.41
CYP3A4 P08684 3/20 0.33
CYP2D6 P10635 1/20 0.33
HIF1A Q16665 1/20 0.33
ALDH1A1 P00352 2/20 0.32
TSHR P16473 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LMNA P02545 2/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
MEN1 O00255 1/20 0.31
USP2 O75604 1/20 0.31
ESR1 P03372 1/20 0.31
TP53 P04637 1/20 0.31
PGR P06401 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
AR P10275 1/20 0.31
MAPT P10636 1/20 0.31
DRD1 P21728 1/20 0.31
PTGS1 P23219 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
SCHEMBL10642352 0.83 ALDH1A1 (0.33) ALDH1A1TSHRTDP1LMNANR1I2
SCHEMBL27940241 0.81 ALDH1A1 (0.32) ALDH1A1TSHRTDP1LMNANR1I2
SCHEMBL28953728 0.81 SHBG (0.35) SHBG
SCHEMBL10503099 0.80 ESR1 (0.33) ALDH1A1TSHRTDP1ESR1AR
SCHEMBL930120 0.80 CNR1 (0.40)
SCHEMBL225599 0.78 ALDH1A1 (0.48) CYP3A4HIF1AALDH1A1TSHRTDP1
SCHEMBL27932239 0.74
SCHEMBL28172703 0.73 SHBG (0.31) SHBG
SCHEMBL28475875 0.73 CYP3A4 (0.31) SHBGCYP3A4SMN1; SMN2
SCHEMBL324566 0.72 ALDH1A1 (0.58) SHBGCYP3A4CYP2D6HIF1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107429050-A The product of absorbance with reduction 沙特基础工业全球技术有限公司 2017-12-01 CN claimed
CN-107022160-A A kind of compound type corrugated pipe 南通曙光机电工程有限公司 2017-08-08 CN claimed
CN-106459568-A Thermoplastic composition and laser-welded article SABIC环球技术有限责任公司 2017-02-22 CN claimed
CN-104403612-B A kind of uvioresistant can absorb optics adhesion agent composition and the optical bonding sheet of blue light 番禺南沙殷田化工有限公司 2016-08-10 CN claimed
CN-108140682-A Multilayer sheet for solar cell sealing material, method for producing multilayer sheet for solar cell sealing material, and solar cell module 三井—杜邦聚合化学株式会社 2018-06-08 CN disclosed
CN-104769007-B Polycarbonate resin, process for producing the same, and optical molded article 三菱瓦斯化学株式会社 2018-04-06 CN disclosed
CN-107849308-A Plastic modifier 诺华丝国际股份有限公司 2018-03-27 CN disclosed
CN-107849307-A Additive agent mixture 巴斯夫欧洲公司 2018-03-27 CN disclosed
CN-105073893-B High-modulus laser direct forming polycarbonate composite material of plating performance and wide laser window with enhancing and preparation method thereof and purposes 沙特基础全球技术有限公司 2018-02-16 CN disclosed
CN-107429048-A Resin additive composition and antistatic thermoplastic resin composition 株式会社ADEKA 2017-12-01 CN disclosed
CN-106795048-A Laminated glass and intermediate film for laminated glasses 三井—杜邦聚合化学株式会社 2017-05-31 CN disclosed
CN-106661270-A Use of hydroxybenzotriazole derivatives and/or hydroxy indazole derivatives as flame retardants for plastics and flameproof plastic moulded bodies 弗劳恩霍夫应用研究促进协会 2017-05-10 CN disclosed
US-7875743-B2 such as bis(3-formyl-4-(4-methoxycarbonylphenyl)methoxyphenyl)methane, by reacting bis(hydroxymethyl-hydroxyphenyl)alkane with hexamethylene tetramine in presence of acid and hydrolyzing, then reacting with halogenated alkoxycarbonyl hydrocarbon in presence of base HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2011-01-25 US disclosed
US-7858819-B2 Tris(formylphenyl) and novel polynuclear phenol derived therefrom HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-12-28 US disclosed
US-20100099908-A1 TRIS(FORMYLPHENYL) AND NEW POLYNUCLEAR POLYPHENOL DERIVED THEREFROM HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-04-22 US disclosed
CN-101679596-A Super-high refractive index optical resin composition having high heat deflection temperature and excellent thermal stability, optical lens using same and method for manufacturing the optical lens SHIN DAE SPECIALTIES CO LTD 2010-03-24 CN disclosed
US-20100016633-A1 such as bis(3-formyl-4-(4-methoxycarbonylphenyl)methoxyphenyl)methane, by reacting bis(hydroxymethyl-hydroxyphenyl)alkane with hexamethylene tetramine in presence of acid and hydrolyzing, then reacting with halogenated alkoxycarbonyl hydrocarbon in presence of base HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2010-01-21 US disclosed
CN-101031577-A Poly (arylene ether) composition GEN ELECTRIC (US) 2007-09-05 CN disclosed
CN-1606497-A Sheet and curtain using the same TORAY INDUSTRIES (JP) 2005-04-13 CN disclosed
US-H42-H Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1986-04-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100099908-A1 TRIS(FORMYLPHENYL) AND NEW POLYNUCLEAR POLYPHENOL DERIVED THEREFROM AS3MT, RRM2, SHROOM3 SHBG 1626/4885CYP3A4 940/4885CYP2D6 1533/4885
US-20100016633-A1 such as bis(3-formyl-4-(4-methoxycarbonylphenyl)methoxyphenyl)methane, by reacting bis(hydroxymethyl-hydroxyphenyl)alkane with hexamethylene tetramine in presence of acid and hydrolyzing, then reacting with halogenated alkoxycarbonyl hydrocarbon in presence of base PAH, PGM2, HNMT SHBG 2845/4885CYP3A4 257/4885CYP2D6 173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.