SCHEMBL6568828

SCHEMBL6568828

CCc1c(C)ccc(O)c1C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.38
ESR2 Q92731 9/20 0.38
AR P10275 4/20 0.38
TDP1 Q9NUW8 3/20 0.35
TP53 P04637 2/20 0.35
ALDH1A1 P00352 3/20 0.33
ALOX15 P16050 3/20 0.33
HSD17B10 Q99714 2/20 0.33
NOS3 P29474 1/20 0.33
NOS2 P35228 1/20 0.33
HPGD P15428 1/20 0.33
TRPA1 O75762 1/20 0.33
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HIF1A Q16665 1/20 0.32
NR1I2 O75469 1/20 0.32
LMNA P02545 1/20 0.32
CYP2C9 P11712 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
SCHEMBL9789808 0.86 ESR1 (0.38) ESR1ESR2ARTDP1TP53
SCHEMBL27515342 0.84 ESR1 (0.38) ESR1ESR2ARTDP1ALDH1A1
SCHEMBL985924 0.79 ESR1 (0.44) ESR1ESR2ARALDH1A1CYP3A4
SCHEMBL6323325 0.78 HSPA5 (0.37) ESR1ESR2ARTDP1TP53
SCHEMBL10410769 0.77 ALDH1A1 (0.33) ESR1ESR2ARTDP1TP53
SCHEMBL27905066 0.76 ESR1 (0.43) ESR1ESR2ARTDP1TP53
SCHEMBL21981883 0.76 ESR1 (0.40) ESR1ESR2ARTDP1TP53
SCHEMBL36472 0.76 ESR1 (0.43) ESR1ESR2ARTDP1TP53
SCHEMBL29359879 0.76 ESR1 (0.43) ESR1ESR2ARTDP1TP53
SCHEMBL28933181 0.74 TYR (0.34) ESR1ESR2TP53TRPA1SMN1; SMN2

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
EP-1484334-A2 Process for producing phosphite SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2004-12-08 EP disclosed
US-20040225145-A1 Process for producing phosphite SUMITOMO CHEMICAL COMPANY, LIMITED 2004-11-11 US disclosed
WO-1999046227-A1 METHOD FOR PRODUCING 2,2'-DIHYDROXYBIPHENYLS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-09-16 WO disclosed
US-4380676-A Process for the production of 2,2'-dihydroxy-biphenyls CIBA-GEIGY CORPORATION (US) 1983-04-19 US disclosed
US-4147663-A Oxidative coupling of alkylphenols, alkoxyphenols and naphthols catalyzed by metal complexes of amino carboxylic and amino sulfonic acids ICI AMERICAS INC. (US) 1979-04-03 US disclosed
US-4139544-A Oxidative coupling of alkylphenols catalyzed by metal complexes of polyimino acids ICI AMERICAS INC. (US) 1979-02-13 US disclosed
US-4132722-A Oxidative coupling of alkylphenols catalyzed by metal complexes of diimino acid ICI AMERICAS INC. (US) 1979-01-02 US disclosed
US-4130504-A COPPER COMPOUND, ANIONIC SURFACTANT, ALKALINE MATERIAL AS CATALYST ICI AMERICAS INC. (US) 1978-12-19 US disclosed
US-4108908-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of thio-acid compounds ICI AMERICAS INC. (US) 1978-08-22 US disclosed
US-4101561-A Oxidative coupling of alkylphenols catalyzed by metal complexes of imino acid compounds ICI AMERICAS INC. (US) 1978-07-18 US disclosed
US-4100205-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of aminoketo compounds ICI AMERICAS INC. (US) 1978-07-11 US disclosed
US-4100206-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of keto alcohol compounds ICI AMERICAS INC. (US) 1978-07-11 US disclosed
US-4100202-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by cupric complexes ICI AMERICAS INC. (US) 1978-07-11 US disclosed
US-4100203-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of an oxime of a keto or aldehyde compound ICI AMERICAS INC. (US) 1978-07-11 US disclosed
US-4100204-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of a hydroxy- or keto-acid compound ICI AMERICAS INC. (US) 1978-07-11 US disclosed
US-4098830-A OXIDATIVE COUPLING OF ALKYLPHENOLS OR 1-NAPHTHOLS CATALYZED BY METAL COMPLEXES OF DICARBOXYLIC ACID COMPOUNDS ICI AMERICAS INC. (US) 1978-07-04 US disclosed
US-4097461-A Oxidative coupling of alkylphenols or 1-naphthols catalyzed by metal complexes of diketo compounds ICI AMERICAS INC. (US) 1978-06-27 US disclosed
US-4096190-A Oxidative coupling of alkylphenols catalyzed by metal ammonia complexes ICI AMERICAS INC. (US) 1978-06-20 US disclosed
US-4085124-A Oxidative coupling of alkylphenols, alkoxyphenols and 1-naphthols catalyzed by metal complexes of amino compounds ICI AMERICAS INC. (US) 1978-04-18 US disclosed
US-4067890-A Oxidative coupling of alkylphenols, alkoxyphenols and naphthols catalyzed by metal complexes of amino carboxylic and amino sulfonic acids ICI AMERICA INC. (US) 1978-01-10 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 (1 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-20040225145-A1 Process for producing phosphite PHOSPHO1, PLCG1, PLCG2 ESR1 3917/4885ESR2 3325/4885AR 2648/4885

“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.