SCHEMBL9940995

SCHEMBL9940995

C=CCNc1ccco1

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
SCHEMBL10644016 0.78
SCHEMBL28209818 0.71
SCHEMBL2490268 0.71
SCHEMBL29023663 0.71
SCHEMBL9602501 0.71 ALDH1A1 (0.37)
Hydrochloric Acid SCHEMBL9592766 0.70
SCHEMBL2210122 0.68
SCHEMBL28689647 0.68 KMT2A (0.51)
SCHEMBL9869417 0.68
SCHEMBL7445493 0.68 KMT2A (0.55)

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2651910-B1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER-DANIELS-MIDLAND COMPANY (US) 2016-12-07 EP claimed
CN-103443090-B Preparation of aminomethyl furan and alkoxymethyl furan derivatives from carbohydrates 阿彻丹尼尔斯米德兰德公司 2016-08-24 CN claimed
US-8669383-B2 Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates ARCHER DANIELS MIDLAND COMPANY (US) 2014-03-11 US claimed
CN-103443090-A Preparation of aminomethyl furan and alkoxymethyl furan derivatives from carbohydrates ARCHER DANIELS MIDLAND CO 2013-12-11 CN claimed
US-20130303791-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER DANIELS MIDLAND COMPANY (US) 2013-11-14 US claimed
EP-2651910-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES Archer-Daniels-Midland Company (US) 2013-10-23 EP claimed
WO-2012082665-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER DANIELS MIDLAND COMPANY (US) 2012-06-21 WO claimed
EP-2651910-B1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER-DANIELS-MIDLAND COMPANY (US) 2016-12-07 EP disclosed
CN-103443090-B Preparation of aminomethyl furan and alkoxymethyl furan derivatives from carbohydrates 阿彻丹尼尔斯米德兰德公司 2016-08-24 CN disclosed
EP-2752408-B1 Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates ARCHER DANIELS MIDLAND CO (US) 2016-05-18 EP disclosed
US-8901326-B2 Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates ARCHER DANIELS MIDLAND COMPANY (US) 2014-12-02 US disclosed
EP-2752408-A1 Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates Archer-Daniels-Midland Company (US) 2014-07-09 EP disclosed
US-20140148605-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER DANIELS MIDLAND COMPANY (US) 2014-05-29 US disclosed
US-8669383-B2 Preparation of aminomethyl furans and alkoxymethyl furan derivatives from carbohydrates ARCHER DANIELS MIDLAND COMPANY (US) 2014-03-11 US disclosed
CN-103443090-A Preparation of aminomethyl furan and alkoxymethyl furan derivatives from carbohydrates ARCHER DANIELS MIDLAND CO 2013-12-11 CN disclosed
US-20130303791-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER DANIELS MIDLAND COMPANY (US) 2013-11-14 US disclosed
EP-2651910-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES Archer-Daniels-Midland Company (US) 2013-10-23 EP disclosed
WO-2012082665-A1 PREPARATION OF AMINOMETHYL FURANS AND ALKOXYMETHYL FURAN DERIVATIVES FROM CARBOHYDRATES ARCHER DANIELS MIDLAND COMPANY (US) 2012-06-21 WO disclosed
US-4490533-A Aminoalkyl pyridine derivatives MERCK & CO., INC. (US) 1984-12-25 US disclosed