SCHEMBL162934

SCHEMBL162934

CC(C)([O])[O]

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2443 0.83
SCHEMBL22749124 0.77
SCHEMBL1006386 0.77
SCHEMBL20395897 0.77
SCHEMBL140788 0.72
SCHEMBL5468570 0.72
SCHEMBL3141775 0.72
SCHEMBL2445716 0.72
SCHEMBL11761205 0.72
SCHEMBL330407 0.72

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 1047 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174979-B2 Phenanthroindolizidine compound and NFκB inhibitor containing same as active ingredient KABUSHIKI KAISHA YAKULT HONSHA (JP) 2015-11-03 US claimed
EP-2351754-B1 PHENANTHROINDOLIZIDINE COMPOUND AND NF kB INHIBITOR CONTAINING SAME AS ACTIVE INGREDIENT YAKULT HONSHA KK (JP) 2015-06-24 EP claimed
EP-2351753-B1 PHENANTHROINDOLIZIDINE DERIVATIVE AND NF kB INHIBITOR CONTAINING SAME AS ACTIVE INGREDIENT YAKULT HONSHA KK (JP) 2015-02-11 EP claimed
US-8865742-B2 Intermediate compounds and processes for the preparation of quinoline derivatives such as Laquinimod sodium MAPI PHARMA LTD. (IL) 2014-10-21 US claimed
EP-2276740-B1 IMPROVED PROCESS FOR PREPARING QUINOLINE-3-CARBOXAMIDE DERIVATIVES ACTAVIS GROUP PCT EHF (IS) 2014-08-13 EP claimed
US-20140005401-A1 Process for Preparing Quinoline-3-Carboxamide Derivatives ACTAVIS GROUP PTC EHF (IS) 2014-01-02 US claimed
US-8569327-B2 Phenanthroindolizidine derivative and NFκB inhibitor containing same as active ingredient KABUSHIKI KAISHA YAKULT HONSHA (JP) 2013-10-29 US claimed
US-8552194-B2 Process for preparing quinoline-3-carboxamide derivatives ACTAVIS GROUP PTC EHF (IS) 2013-10-08 US claimed
EP-2642855-A1 INTERMEDIATE COMPOUNDS AND PROCESSES FOR THE PREPARATION OF QUINOLINE DERIVATIVES SUCH AS LAQUINIMOD SODIUM Mapi Pharma Limited (IL) 2013-10-02 EP claimed
US-20130245065-A1 INTERMEDIATE COMPOUNDS AND PROCESSES FOR THE PREPARATION OF QUINOLINE DERIVATIVES SUCH AS LAQUINIMOD SODIUM MAPI PHARMA LTD. (IL) 2013-09-19 US claimed
US-4167569-A ANTICOAGULANTS IMPERIAL CHEMICAL INDUSTRIES LIMITED (GB) 1979-09-11 US claimed
EP-0002895-A1 Enzyme inhibitory phthalazin-4-ylacetic acid derivatives, pharmaceutical compositions thereof, and process for their manufacture IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1979-07-11 EP claimed
US-4124707-A 7α-Halogeno-3,20-dioxo-1,4-pregnadienes, methods for their manufacture, their use as anti-inflammatory agents, and pharmaceutical formulations useful therefor SCHERING CORPORATION (US) 1978-11-07 US claimed
US-4049804-A Novel pregnanoic acid derivatives SCHERING AKTIENGESELLSCHAFT (DT) 1977-09-20 US claimed
US-4039668-A CORTICOID-CONTAINING INHALANTS SCHERING AKTIENGESELLSCHAFT (DT) 1977-08-02 US claimed
US-4036831-A Trimethyl siloxane steroid intermediates STEROID DEVELOPMENT COMPANY ESTABLISHMENT (CH) 1977-07-19 US claimed
US-4020171-A CHEMICAL INTERMEDIATES SAGAMI CHEMICAL RESEARCH CENTER (JA) 1977-04-26 US claimed
US-4011315-A 21-ACETALS AND MIXED ACETALS OF STEROIDAL 21-ALDEHYDES, INTERMEDIATES AND METHODS OF PREPARATION SYNTEX (U.S.A.) INC. (US) 1977-03-08 US claimed
US-3996358-A 21-Esters of steroidal-21-aldehyde hydrates and 21-aldehyde hemiacetals and methods of preparation SYNTEX (U.S.A.) INC. (US) 1976-12-07 US claimed
US-3931167-A Process for the manufacture of 3-keto-6-azido-4,6-bis-dehydro-steroids and intermediates useful therein SCHERING CORPORATION (US) 1976-01-06 US claimed