SCHEMBL1837486

SCHEMBL1837486

CCCC(C)(C)c1ccc(O)c(C(C)(C)CCC)c1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 12/20 0.50
ESR2 Q92731 6/20 0.50
AR P10275 2/20 0.50
CNR1 P21554 8/20 0.48
CNR2 P34972 8/20 0.48

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
SCHEMBL5688957 0.91 ALDH1A1 (0.50) ESR1ESR2ARCNR1CNR2
SCHEMBL1840546 0.89 ESR1 (0.53) ESR1ESR2ARCNR1CNR2
SCHEMBL768278 0.88 CNR2 (0.57) ESR1ESR2CNR1CNR2
SCHEMBL1835453 0.86 CNR2 (0.59) CNR1CNR2
SCHEMBL1842387 0.86 CNR2 (0.59) CNR1CNR2
SCHEMBL30785198 0.86 CNR2 (0.59) CNR1CNR2
SCHEMBL1834750 0.86 CNR2 (0.59) CNR1CNR2
SCHEMBL11781083 0.86 CNR2 (0.59) CNR1CNR2
SCHEMBL1837690 0.86 CNR2 (0.59) CNR1CNR2
SCHEMBL11799178 0.83 CNR1 (0.42) ESR1ESR2ARCNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0769487-B1 Process for preparing carboxyl groups containing alkyl aryl ethers BAYER AG (DE) 2000-01-26 EP claimed
US-5869735-A Process for the preparation of alkyl aryl ethers containing carboxyl groups BAYER AKTIENGESELLSCHAFT (DE) 1999-02-09 US claimed
EP-0769487-A2 Process for preparing carboxyl groups containing alkyl aryl ethers BAYER AG (DE) 1997-04-23 EP claimed
JP-63057636-A None JP disclosed
EP-3838892-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2022-10-12 EP disclosed
EP-3293173-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2021-07-28 EP disclosed
EP-3838892-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Kabushiki Kaisha (JP) 2021-06-23 EP disclosed
EP-2980066-B1 METHOD FOR PRODUCING ISOCYANATE ASAHI CHEMICAL IND (JP) 2021-04-21 EP disclosed
EP-3153499-B1 METHOD FOR PRODUCING N-SUBSTITUTED CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2018-09-19 EP disclosed
EP-3293173-A1 METHOD FOR PRODUCING ISOCYANATE Asahi Kasei Kabushiki Kaisha (JP) 2018-03-14 EP disclosed
EP-2322504-B9 PROCESS FOR THE PREPARATION OF N-SUBSTITUTED CARBAMIC ACID ESTER AND PROCESS FOR THE PREPARATION OF ISOCYANATE USING THE N-SUBSTITUTED CARBAMIC ACID ESTER ASAHI CHEMICAL IND (JP) 2017-09-06 EP 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-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-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-4070383-A COPPER COMPOUND-ANIONIC SURFACTANT-ALKALI METAL COMPOUND CATALYST SYSTEM ICI AMERICAS INC. (US) 1978-01-24 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
US-3992308-A Lubricating oil composition containing sulfurized reaction product of mixed tertiary alkyl phenols with formaldehyde ETHYL CORPORATION (US) 1976-11-16 US disclosed